| MCULE-6555695611 |
1 |
N12C[C@@H](C[C@@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)O
|
|
| MCULE-7932600030 |
1 |
C1(CC2C=CC=CC=2)C(=O)N2CC(O)CC2C(=O)N1
|
|
| MCULE-5315759293 |
1 |
C1C=C(C[C@H]2C(=O)N3C[C@H](O)C[C@@]3([H])C(=O)N2)C=CC=1
|
|
| MCULE-4072881079 |
1 |
N12C[C@@H](C[C@H]1C(=O)N[C@H](CC1=CC=CC=C1)C2=O)O
|
|
| MCULE-7568108718 |
1 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)O
|
|
| MolPort-044-696-790 |
1 |
O[C@@H]1C[C@@H]2N(C1)C(=O)[C@@H](CC1=CC=CC=C1)NC2=O
|
|
| MolPort-039-338-193 |
1 |
OC1CC2N(C1)C(=O)C(CC1=CC=CC=C1)NC2=O
|
|
| MolPort-039-338-407 |
1 |
O[C@@H]1C[C@@H]2N(C1)C(=O)[C@H](CC1=CC=CC=C1)NC2=O
|
|
| MolPort-045-928-247 |
1 |
O[C@@H]1C[C@H]2N(C1)C(=O)[C@H](CC1=CC=CC=C1)NC2=O
|
|
| MCULE-8632359270 |
0.98 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCNCC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-9151936645 |
0.97 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)CN1CCCCC1=O)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-7455381480 |
0.97 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(C1CCC1)=O)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MolPort-045-917-612 |
0.97 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)CN1CCCCC1=O
|
|
| MolPort-045-931-951 |
0.97 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)C1CCC1
|
|
| MCULE-8880665119 |
0.96 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(CC(C)(C)C)=O)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MolPort-046-581-789 |
0.96 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC1=O)NC(=O)CC(C)(C)C
|
|
| MCULE-4392787171 |
0.95 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(C1CCC1)=O)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MolPort-046-567-250 |
0.95 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC1=O)NC(=O)C1CCC1
|
|
| MCULE-5929049755 |
0.94 |
N12C[C@@H](C[C@H]1C(=O)N[C@H](CC1C=CC(=CC=1)O)C2=O)O
|
|
| MCULE-3911198149 |
0.94 |
C1(CC2C=CC(O)=CC=2)C(=O)N2CC(O)CC2C(=O)N1
|
|
| MCULE-9436866727 |
0.94 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(CCCN1CCCC1=O)=O)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-9351724008 |
0.94 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)C1(C)COC1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-2853128092 |
0.94 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)CCOC)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-9240702278 |
0.94 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(C1CCCC1)=O)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MolPort-039-338-194 |
0.94 |
OC1CC2N(C1)C(=O)C(CC1=CC=C(O)C=C1)NC2=O
|
|
| MolPort-044-705-862 |
0.94 |
O[C@@H]1C[C@@H]2N(C1)C(=O)[C@@H](CC1=CC=C(O)C=C1)NC2=O
|
|
| MolPort-045-931-849 |
0.94 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)CCOC
|
|
| MolPort-045-932-790 |
0.94 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)C1CCCC1
|
|
| MolPort-045-919-179 |
0.94 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)C1(C)COC1
|
|
| MolPort-045-937-188 |
0.94 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)CCCN1CCCC1=O
|
|
| MCULE-1735847808 |
0.93 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(=O)C(C)(C)C1C=CC=CC=1)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-1637616349 |
0.93 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)C1CCN(CC1)C(C)C)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-4354008734 |
0.93 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)C1CCN(CC1)C(C)=O)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-8219620539 |
0.93 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)CC1CCCC1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-2768826377 |
0.93 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)CCC1=CC=CC=C1C)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-1169533905 |
0.93 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(C1CCCCCC1)=O)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MolPort-045-933-210 |
0.93 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)C1CCCCCC1
|
|
| MolPort-045-936-103 |
0.93 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)CC1CCCC1
|
|
| MolPort-045-937-214 |
0.93 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)C1CCN(CC1)C(C)C
|
|
| MolPort-045-916-932 |
0.93 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)C1CCN(CC1)C(C)=O
|
|
| MolPort-046-577-865 |
0.93 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC1=O)NC(=O)C(C)(C)C1=CC=CC=C1
|
|
| MolPort-045-918-584 |
0.93 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)CCC1=C(C)C=CC=C1
|
|
| MCULE-1543001266 |
0.92 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(=O)CC(C1=CC=CC=C1)C1=CC=CC=C1)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-2001356501 |
0.92 |
N(C(CC(C)C)C(=O)NC(C(=O)NC(C)(C)C(=O)N1CC(O)CC1C(=O)NC(CCC(N)=O)C(=O)NC(C)(C)C(=O)N1CC(O)CC1C(=O)NC(C)(C(NC(CC1C=CC=CC=1)CO)=O)C)(C)C)C(=O)CNC(=O)C(C(C)C)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C(C)(NC(=O)C(NC(C)=O)CC1C=CC=CC=1)C
|
|
| MCULE-8833153687 |
0.92 |
CC(=O)NC(CC1C=CC=CC=1)C(=O)NC(C)(C)C(NC(C(NC(C(=O)NC(C(C)C)C(=O)NCC(=O)NC(CC(C)C)C(=O)NC(C(=O)NC(C)(C)C(N1CC(O)CC1C(=O)NC(CCC(N)=O)C(=O)NC(C)(CC)C(=O)N1CC(O)CC1C(=O)NC(C)C(=O)NC(CC1C=CC=CC=1)CO)=O)(C)C)(C)C)=O)(C)C)=O
|
|
| MCULE-1682777383 |
0.92 |
C1(N(C(=O)C(CC)(C)NC(=O)C(CCC(N)=O)NC(=O)C2N(C(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C(NC(=O)CNC(=O)C(C(C)C)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(C(NC(=O)C(CC3C=CC=CC=3)NC(=O)C)(C)C)=O)CC(C)C)CC(C2)O)CC(O)C1)C(=O)NC(C)(C)C(=O)NC(CO)CC1C=CC=CC=1
|
|
| MCULE-9285938555 |
0.92 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(COC)=O)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-3252605615 |
0.92 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(CCCC1C=CC=CC=1)=O)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-7373808131 |
0.92 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)C(C)(C)OC)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MolPort-045-931-774 |
0.92 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)C(C)(C)OC
|
|
| MolPort-045-935-132 |
0.92 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)COC
|
|
| MolPort-046-577-151 |
0.92 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC1=O)NC(=O)CCCC1=CC=CC=C1
|
|
| MolPort-005-944-434 |
0.92 |
CC(C)CC(NC(=O)CNC(=O)C(NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C(CC1=CC=CC=C1)NC(C)=O)C(C)C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)N1CC(O)CC1C(=O)NC(CCC(N)=O)C(=O)NC(C)(C)C(=O)N1CC(O)CC1C(=O)NC(C)(C)C(=O)NC(CO)CC1=CC=CC=C1
|
|
| MolPort-019-931-698 |
0.92 |
CCC(C)(NC(=O)C(CCC(N)=O)NC(=O)C1CC(O)CN1C(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C(CC(C)C)NC(=O)CNC(=O)C(NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)C(CC1=CC=CC=C1)NC(C)=O)C(C)C)C(=O)N1CC(O)CC1C(=O)NC(C)(C)C(=O)NC(CO)CC1=CC=CC=C1
|
|
| MolPort-046-567-243 |
0.92 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC1=O)NC(=O)CC(C1=CC=CC=C1)C1=CC=CC=C1
|
|
| MCULE-2018879292 |
0.91 |
C1(C(O)C)C(=O)NC(C)C(=O)NC(C(C)CC)C(N2CCCC2C(=O)NC(C(=O)NC(CC(C)C)C(=O)NC(CO)C(=O)NC(CC2C=CC=CC=2)C(=O)N1)CC(C)C)=O
|
|
| MolPort-044-637-516 |
0.91 |
CCC(C)C1NC(=O)C(C)NC(=O)C(NC(=O)C(CC2=CC=CC=C2)NC(=O)C(CO)NC(=O)C(CC(C)C)NC(=O)C(CC(C)C)NC(=O)C2CCCN2C1=O)C(C)O
|
|
| MolPort-040-725-324 |
0.90 |
CC(C)C1(CN(C1)C(=O)[C@H]1C[C@H](O)CN1C(C)=O)C1=CC=CC=C1
|
|
| MolPort-045-915-150 |
0.90 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)CN1CCOCC1
|
|
| MolPort-046-573-530 |
0.90 |
COC(C)(C)C(=O)N[C@H]1CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC2=CC=CC=C2)NC1=O
|
|
| MCULE-5609855852 |
0.90 |
CC(C1(C2=CC=CC=C2)CN(C([C@@H]2N(C(C)=O)C[C@@H](O)C2)=O)C1)C
|
|
| MCULE-2639019958 |
0.90 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(=O)C(C)(C)OC)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-7496344619 |
0.90 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)CN1CCOCC1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MolPort-045-919-188 |
0.89 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)CN1CCN(C)C1=O
|
|
| MolPort-045-936-488 |
0.89 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)C1CCOCC1
|
|
| MolPort-045-934-835 |
0.89 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)[C@@H]1CC[C@H](O)CC1
|
|
| MolPort-045-935-062 |
0.89 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)[C@H]1CC[C@H](O)CC1
|
|
| MCULE-9647374688 |
0.89 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)[C@H]1CC[C@@H](CC1)O)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-9767277823 |
0.89 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(C1CCOCC1)=O)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-8772953444 |
0.89 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)[C@H]1CC[C@H](CC1)O)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-8519719679 |
0.89 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)CN1CCN(C)C1=O)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MolPort-045-938-662 |
0.88 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)CN1C(=O)CNC1=O
|
|
| MolPort-013-172-941 |
0.88 |
OC1CNC(C1)C(=O)N1CCC(C1)C1=CC=CC=C1
|
|
| MCULE-4161459973 |
0.88 |
N1(C(=O)CNC1=O)CC(=O)N1CCNC(=O)[C@H](CC2=CC=CC=C2)NC([C@@H]2C[C@@H](O)CN2C(=O)[C@H]([C@@H](C)CC)NC(=O)C1)=O
|
|
| MCULE-7542975113 |
0.88 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)COC(C)C)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-4304803445 |
0.88 |
OC1CC(C(N2CC(C3C=CC=CC=3)CC2)=O)NC1
|
|
| MCULE-9577631481 |
0.88 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(CN(C)C)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-1447195285 |
0.88 |
N12CCC[C@H]1C(=O)NCCCC[C@H](N)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-5396903564 |
0.88 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(C)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
|
|
| MCULE-6777756892 |
0.88 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)C(C)(C)C)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-3700891361 |
0.88 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(CC(C)C)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-1335218727 |
0.88 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(C(C)C)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
|
|
| MCULE-2749026812 |
0.88 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(CCC(C)C)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
|
|
| MCULE-7115387830 |
0.88 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(C(=O)[C@@H]2CCC(=O)N2)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-9248755756 |
0.88 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(C(=O)[C@H]2CCC(=O)N2)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-9840027170 |
0.88 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(C1CCOCC1)=O)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-7710054995 |
0.88 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(CC1C=CC=CC=1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-9230155618 |
0.88 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)CC1C=CC=C(O)C=1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-1641575570 |
0.88 |
C(N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)O)CC(C)C)CC1C=CC=CC=1)(=O)[C@H](CC1C=CC=CC=1)NC([C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@@H](N)CC(C)C)=O
|
|
| MolPort-046-569-339 |
0.88 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CCC(C)C
|
|
| MolPort-046-568-348 |
0.88 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CC(C)C
|
|
| MolPort-046-567-777 |
0.88 |
CC[C@@H]1NC(=O)[C@@H](N)CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O
|
|
| MolPort-046-568-748 |
0.88 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)C(C)(C)C
|
|
| MolPort-046-568-512 |
0.88 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(C)=O
|
|
| MolPort-046-569-548 |
0.88 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CN(C)C
|
|
| MolPort-046-569-803 |
0.88 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)C(C)C
|
|
| MolPort-046-577-859 |
0.88 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC1=O)NC(=O)C1CCOCC1
|
|
| MolPort-045-916-772 |
0.88 |
CC[C@H](C)[C@@H]1NC(=O)CN(CC2=CC=CC=C2)CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O
|
|
| MolPort-045-931-863 |
0.88 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)CC1=CC(O)=CC=C1
|
|
| MolPort-046-418-705 |
0.88 |
CC(C)C[C@H](N)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CC(C)C)C(O)=O
|
|
| MolPort-039-084-682 |
0.87 |
CC(=O)N1C[C@@H](O)C[C@@H]1C(=O)NCCC1=CC=CC2=CC=CC=C12
|
|
| MolPort-011-711-311 |
0.87 |
OC1CNC(C1)C(=O)NC1CC1C1=CC=CC=C1
|
|
| MCULE-1535871248 |
0.87 |
N1(C[C@@H]2C[C@@H](CN2C(=O)[C@@H]1CC1C=CC=CC=1)OC)C(=O)C1(C)CC1
|
|
| MCULE-6275157544 |
0.87 |
OC1CC(C(NC2C(C3=CC=CC=C3)C2)=O)NC1
|
|
| MCULE-3503591547 |
0.87 |
CC(N1[C@@H](C(NCCC2=C3C(C=CC=C3)=CC=C2)=O)C[C@H](O)C1)=O
|
|
| MCULE-9172340028 |
0.87 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(CC1CC1)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-9364845156 |
0.87 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(C1CCC1)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-6002733524 |
0.87 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(CC(=O)N[C@@H]([C@@H](C)CC)C2=O)C(=O)[C@@H]1CCCN2CCCC[C@]12[H])O
|
|
| MCULE-4201262296 |
0.87 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(CCCN1CCOCC1)=O)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MolPort-042-694-792 |
0.87 |
C[C@@H](O)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)[C@@H](C)O)[C@@H](C)O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(O)=O
|
|
| MolPort-046-570-575 |
0.87 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)C1CCC1
|
|
| MolPort-046-567-757 |
0.87 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CC1CC1
|
|
| MolPort-045-934-814 |
0.87 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)CCCN1CCOCC1
|
|
| MolPort-045-916-966 |
0.86 |
CC(C)CCC(=O)N1CCNC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](NC(=O)C1)C(C)C
|
|
| MolPort-044-639-113 |
0.86 |
CO[C@H]1C[C@H]2CN(CCC(C)C)[C@@H](CC3=CC=CC=C3)C(=O)N2C1
|
|
| MCULE-4288999454 |
0.86 |
N1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C(C)C)NC(CN(C(CCC(C)C)=O)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-2684086533 |
0.86 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2C=CC=CC=2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(CCC(C)C)=O
|
|
| MCULE-9809996763 |
0.86 |
N12C[C@H](C[C@H]1CN([C@@H](CC1=CC=CC=C1)C2=O)CCC(C)C)OC
|
|
| MCULE-6160991859 |
0.86 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)[C@H]1CCC(=O)N1)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-3827613717 |
0.86 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(CCC1CCCC1)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
|
|
| MCULE-6736302750 |
0.86 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)[C@@H]1CCC(=O)N1)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-7764032794 |
0.86 |
C(N)(=O)[C@H]([C@H](O)C)NC(=O)[C@]1(CC2=CC=CC=C2)CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H]([C@H](O)C)N
|
|
| MCULE-5493102568 |
0.86 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(CC[C@@H]1CCCN3CCCC[C@@]31[H])=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-1187867449 |
0.86 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)CN1CCCC1=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
|
|
| MCULE-9919385224 |
0.86 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(CC1C=CC(=CC=1)C(F)(F)F)=O)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-7115666786 |
0.86 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(=O)C1(CCCCC1)C1C=CC=CC=1)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-4930179276 |
0.86 |
CC(N1[C@@H](C(NC2(CCCC2)CC2=CC=CC=C2)=O)C[C@H](O)C1)=O
|
|
| MolPort-046-570-778 |
0.86 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)[C@H]1CCC(=O)N1
|
|
| MolPort-046-576-795 |
0.86 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC1=O)NC(=O)C1(CCCCC1)C1=CC=CC=C1
|
|
| MolPort-046-569-280 |
0.86 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CC[C@@H]1CCCN2CCCC[C@H]12
|
|
| MolPort-046-788-295 |
0.86 |
C[C@@H](O)[C@H](N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@@]1(CC1=CC=CC=C1)C(=O)N[C@@H]([C@@H](C)O)C(N)=O
|
|
| MolPort-046-570-274 |
0.86 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)[C@@H]1CCC(=O)N1
|
|
| MolPort-046-567-931 |
0.86 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CN1CCCC1=O
|
|
| MolPort-046-570-072 |
0.86 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)C12CC3CC(CC(C3)C1)C2
|
|
| MolPort-046-567-185 |
0.86 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CCC1CCCC1
|
|
| MolPort-046-569-790 |
0.86 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC1=O)NC(=O)CC1=CC=C(C=C1)C(F)(F)F
|
|
| MolPort-039-238-235 |
0.86 |
CC(=O)N1C[C@@H](O)C[C@@H]1C(=O)NC1(CC2=CC=CC=C2)CCCC1
|
|
| MolPort-046-117-332 |
0.85 |
CCC1=CC=C(C=C1)C1CCN(CC1)C(=O)[C@H]1C[C@@H](O)CN1C(C)=O
|
|
| MolPort-045-932-707 |
0.85 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2)NC1=O)[C@@H](C)O)C(=O)C1C(C)(C)C1(C)C
|
|
| MolPort-039-113-900 |
0.85 |
CN1CCC(CNC(=O)[C@@H]2C[C@@H](O)CN2)(CC1)C1=CC=CC=C1
|
|
| MolPort-039-300-224 |
0.85 |
CC(=O)N1CCCC1C(=O)N[C@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-039-300-277 |
0.85 |
CC(=O)N1CCCC1C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-046-570-719 |
0.85 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CC1=CC=CC=C1
|
|
| MolPort-046-570-377 |
0.85 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CCOC
|
|
| MolPort-046-099-143 |
0.85 |
CC(=O)N1C[C@H](O)C[C@@H]1C(=O)NC1CC2=CC=CC=C2C1
|
|
| MolPort-046-451-940 |
0.85 |
CC(=O)N1C[C@@H](O)C[C@@H]1C(=O)N1CCCC1CC1=CC=C(C)C=C1
|
|
| MCULE-5197537381 |
0.85 |
CCC1=CC=C(C2CCN(C([C@@H]3N(C(C)=O)C[C@H](O)C3)=O)CC2)C=C1
|
|
| MCULE-2105660904 |
0.85 |
C1(C)(C)C(C1(C)C)C(=O)N1CCNC(=O)[C@H]([C@@H](C)O)NC([C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C(C)C)NC(=O)C1)=O
|
|
| MCULE-1018642570 |
0.85 |
N1C[C@@H](C[C@H]1C(=O)NCC1(C2C=CC=CC=2)CCN(CC1)C)O
|
|
| MCULE-5508608874 |
0.85 |
CCCC(N1C(C(NC(C(=O)O)CC2C=CC=CC=2)=O)CCC1)=O
|
|
| MCULE-7046219617 |
0.85 |
CC(CC(N1C(C(NC(C(=O)O)CC2C=CC=CC=2)=O)CCC1)=O)(C)C
|
|
| MCULE-7690712869 |
0.85 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)CC1=CC=CC=C1Cl)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-8142918291 |
0.85 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(CC1C=CC=CC=1)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-6287368331 |
0.85 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)CCOC)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
|
|
| MCULE-8192558109 |
0.85 |
CC(N1[C@@H](C(NC2CC3=C(C=CC=C3)C2)=O)C[C@@H](O)C1)=O
|
|
| MolPort-046-581-426 |
0.84 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC1=O)NC(=O)CC1=C(Cl)C=CC=C1
|
|
| MolPort-045-931-794 |
0.84 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)C1=CC=CC=C1
|
|
| MolPort-045-933-820 |
0.84 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC1=O)C(=O)CN1CCC(CC1)C1=CC=CC=C1
|
|
| MolPort-045-915-848 |
0.84 |
CC(C)[C@H]1NC(=O)CN(CC2CCC2)CCNC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC1=O
|
|
| MolPort-045-917-531 |
0.84 |
CC(C)C[C@@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@H](N)CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O
|
|
| MolPort-046-702-226 |
0.84 |
CC(C)C(NC(=O)C(CC(O)=O)NC(=O)C(CC1=CC=C(O)C=C1)NC(=O)C1CCCN1C(=O)C(N)CC1=CC=C(O)C=C1)C(=O)N1CCCC1C(=O)NC(CC(O)=O)C(=O)NC(CC1=CC=C(O)C=C1)C(=O)NC(C)C(O)=O
|
|
| MolPort-045-983-636 |
0.84 |
CC(CC1=CC=C(Cl)C=C1)N(C)C(=O)[C@H]1C[C@H](O)CN1C(C)=O
|
|
| MolPort-020-210-977 |
0.84 |
O[C@@H]1C[C@@H]2N(C1)C(=O)[C@H]1CN(CCCC3=CC=CC=C3)CCN1C2=O
|
|
| MolPort-046-570-524 |
0.84 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)C1CCOCC1
|
|
| MolPort-045-917-408 |
0.84 |
C[C@H](O)[C@H]1NC(=O)[C@H](CC2=CC=CC=C2)NC1=O
|
|
| MCULE-3147070749 |
0.84 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(C1=CC=CC=C1)=O)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-8343143122 |
0.84 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(=O)CC1=CC=CC=C1Cl)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-7557119723 |
0.84 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(=O)CN1CCC(CC1)C1C=CC=CC=1
|
|
| MCULE-1397630579 |
0.84 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2C=CC=CC=2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)CC1CCC1
|
|
| MCULE-8171313121 |
0.84 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)N
|
|
| MCULE-5943340510 |
0.84 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)N
|
|
| MCULE-3749310735 |
0.84 |
N12C[C@@H](C[C@H]1C(=O)N1[C@H](CN(CC1)CCCC1=CC=CC=C1)C2=O)O
|
|
| MCULE-1972863735 |
0.84 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(C1CCOCC1)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-2631087305 |
0.84 |
N1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H]1[C@H](C)O
|
|
| MCULE-5230998165 |
0.84 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(C(CCCN2CCCCC2=O)=O)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-1062324404 |
0.84 |
N1[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CCO)C1=O
|
|
| MCULE-2527812653 |
0.84 |
OC1CC(C(NCC2C3C=CC=CC=3C2)=O)NC1
|
|
| MCULE-9314090264 |
0.84 |
CC(N1[C@@H](C(N[C@H]2[C@H](C3=CC=CC=C3)CN(CC(F)(F)F)C2)=O)C[C@@H](O)C1)=O
|
|
| MCULE-3750526565 |
0.84 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(C(CCCC(C)C)=O)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-1903934885 |
0.84 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(COC)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-1061624773 |
0.84 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)[C@@H]1CCCO1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-3365475477 |
0.84 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)[C@H]1CCCO1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MolPort-045-918-337 |
0.84 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2)NC1=O)[C@@H](C)O)C(=O)CCCN1CCCCC1=O
|
|
| MolPort-045-956-516 |
0.84 |
OCC[C@@H]1NC(=O)[C@H](CC2=CC=CC=C2)NC1=O
|
|
| MolPort-012-968-623 |
0.84 |
OC1CNC(C1)C(=O)NCC1CC2=CC=CC=C12
|
|
| MolPort-046-788-523 |
0.84 |
CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(O)=O
|
|
| MolPort-046-107-432 |
0.84 |
CC(=O)N1C[C@H](O)C[C@@H]1C(=O)N[C@@H]1CN(CC(F)(F)F)C[C@H]1C1=CC=CC=C1
|
|
| MolPort-046-567-367 |
0.84 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)COC
|
|
| MolPort-045-934-517 |
0.84 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)[C@H]1CCCO1
|
|
| MolPort-046-568-836 |
0.83 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)C1CCN(C)CC1
|
|
| MolPort-019-939-180 |
0.83 |
CC(C)[C@H](N)C(=O)NCC(=O)N[C@H](CO)C(=O)N[C@H](CCC(O)=O)C(=O)N[C@H](C)C(=O)N[C@@H](CC1=CC=CC=C1)C(N)=O
|
|
| MolPort-002-119-905 |
0.83 |
CC(C)CC(NC(=O)C(CC1=CC=CC=C1)NC(C)=O)C(O)=O
|
|
| MolPort-016-581-003 |
0.83 |
C[C@@H](NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCC(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(N)=O
|
|
| MolPort-046-567-335 |
0.83 |
CC[C@H]1CN(CC(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N1)C(=O)CO
|
|
| MolPort-046-702-189 |
0.83 |
CC(NC(=O)C(N)CC1=CC=C(O)C=C1)C(=O)NC(CC1=CC=CC=C1)C(=O)NCC(=O)NC(CC1=CC=C(O)C=C1)C(=O)N1CCCC1C(=O)NC(CO)C(N)=O
|
|
| MCULE-9850657697 |
0.83 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)C1CCN(CC1)C)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
|
|
| MCULE-1481751445 |
0.83 |
C(C)(C)[C@@H](C(NCC(N[C@H](CO)C(N[C@H](CCC(O)=O)C(N[C@@H](C(N[C@H](C(N)=O)CC1C=CC=CC=1)=O)C)=O)=O)=O)=O)N
|
|
| MCULE-3764930303 |
0.83 |
C(N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N)(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](C)NC(=O)[C@@H](N)CC1C=CC(O)=CC=1)CC1C=CC=CC=1)CC1C=CC(O)=CC=1
|
|
| MCULE-6526621171 |
0.83 |
C(=O)(C(CC1C=CC=CC=1)NC(C)=O)NC(CC(C)C)C(O)=O
|
|
| MCULE-3944465486 |
0.83 |
N1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C(C)C)NC(CN(CCO)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-2497665272 |
0.83 |
N1(C[C@H](CC)NC(=O)[C@H](CC2=CC=CC=C2)NC([C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C1)=O)C(CO)=O
|
|
| MCULE-9948023262 |
0.83 |
CN1C(C(NCC(NCCC2=CC=CC=C2)=O)=O)(C)CC(O)C1
|
|
| MCULE-8321324636 |
0.83 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(C1=CC=CC=C1)=O)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-8041432928 |
0.83 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(=O)[C@H](OC)C1C=CC=CC=1)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-9155619954 |
0.83 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(CCC1C=NNC=1)=O)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-2232183828 |
0.83 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(CC1C=CC(=CC=1)F)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-4731613510 |
0.83 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)CC(=O)N1CCCCCC1
|
|
| MCULE-7519989368 |
0.83 |
N1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C(C)C)NC(CN(C(CCC2CCN(CC2)C)=O)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-5922598019 |
0.83 |
N1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C(C)C)NC(CN(C(C2CCCC2)=O)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-1693106493 |
0.83 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(C(CCCC2C=CC=CC=2)=O)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-7335277712 |
0.83 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(=O)CN1CCCC1=O
|
|
| MCULE-4816584110 |
0.83 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC(=O)CCO
|
|
| MCULE-6317062538 |
0.83 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC(=O)C(C)(C)C
|
|
| MCULE-9748100137 |
0.83 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(C(=O)CN2CCCCCCC2)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-8429373571 |
0.83 |
CC(N1[C@@H](C(NCC2(C3=CC=CC=C3)CCOCC2)=O)C[C@@H](O)C1)=O
|
|
| MolPort-046-578-573 |
0.83 |
CO[C@@H](C(=O)N[C@H]1CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC2=CC=CC=C2)NC1=O)C1=CC=CC=C1
|
|
| MolPort-046-576-793 |
0.83 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC1=O)NC(=O)C1=CC=CC=C1
|
|
| MolPort-045-925-756 |
0.83 |
CC[C@H](C)[C@@H]1NC(=O)CN(CC2=CC=C(F)C=C2)CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O
|
|
| MolPort-045-918-973 |
0.83 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2)NC1=O)[C@@H](C)O)C(=O)C1CCCC1
|
|
| MolPort-045-918-307 |
0.83 |
CC(C)[C@H]1NC(=O)CN(CC(=O)N2CCCCCC2)CCNC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC1=O
|
|
| MolPort-045-933-689 |
0.83 |
CC(C)C[C@@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)CN1CCCC1=O
|
|
| MolPort-045-946-808 |
0.83 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2)NC1=O)[C@@H](C)O)C(=O)CN1CCCCCCC1
|
|
| MolPort-044-456-982 |
0.83 |
CC(=O)N1C[C@H](O)C[C@@H]1C(=O)NCC1(CCOCC1)C1=CC=CC=C1
|
|
| MolPort-019-939-181 |
0.82 |
CC(C)C[C@@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)NCC(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H]([C@H](C)O)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@H]([C@H](C)O)C(=O)N[C@H](CCC(O)=O)C(=O)N[C@H](C(C)C)C(O)=O
|
|
| MolPort-046-418-698 |
0.82 |
CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(O)=O
|
|
| MolPort-046-702-284 |
0.82 |
CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)CNC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCC(=O)N1)C(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-046-788-477 |
0.82 |
OC(=O)C(F)(F)F.CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CO)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(O)=O
|
|
| MolPort-019-939-156 |
0.82 |
CC(C)C[C@H](NC(=O)CNC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](CO)NC(=O)[C@@H](CC1=CC=C(O)C=C1)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CO)NC(=O)CNC(=O)CN)C(N)=O
|
|
| MolPort-002-515-657 |
0.82 |
OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H]1CCCN1
|
|
| MolPort-045-931-674 |
0.82 |
CC[C@H](C)[C@@H]1NC(=O)CN(CC2=CC(O)=CC=C2)CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O
|
|
| MolPort-045-933-530 |
0.82 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)CC1=CC(OC)=CC=C1
|
|
| MolPort-045-934-219 |
0.82 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)CC1=C(C)C=CC(F)=C1
|
|
| MolPort-046-576-437 |
0.82 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC1=O)NC(=O)[C@H]1CCCO1
|
|
| MolPort-046-577-143 |
0.82 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC1=O)NC(=O)[C@@H]1CCCO1
|
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| MolPort-045-917-199 |
0.82 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2)NC1=O)[C@@H](C)O)C(=O)CNC(C)=O
|
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| MolPort-045-915-297 |
0.82 |
CC(C)[C@H]1NC(=O)CNCCNC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC1=O
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|
| MolPort-045-918-860 |
0.82 |
CC(C)[C@H]1NC(=O)CNCCNC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2)NC1=O)[C@@H](C)O
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| MolPort-045-916-427 |
0.82 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC1=O)C(=O)C(C)C
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|
| MolPort-045-915-663 |
0.82 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC1=O)C(C)=O
|
|
| MCULE-2619734085 |
0.82 |
OC([C@H](NC([C@@H]1NC(=O)CC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-3413824940 |
0.82 |
OCC1(CN(C(C2N(C(CC3=CC=CC=C3)=O)CCC2)=O)CC1)O
|
|
| MCULE-7931757094 |
0.82 |
OC([C@H](NC([C@H]1NC(=O)CC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-6160145629 |
0.82 |
C(N1CCC[C@H]1C(=O)NCC(N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@@H](C)CC)=O)(=O)[C@@H](NC([C@@H]1CCCN1C(=O)[C@@H](N)CC1C=CC(O)=CC=1)=O)CC1C=CC=CC=1
|
|
| MCULE-6667041228 |
0.82 |
C(C1C=CC=CC=1)[C@H](N)C(N[C@H](CC(C)C)C(NCC(N[C@@H](CCC(O)=O)C(N[C@@H](CC(C)C)C(N[C@@H]([C@@H](O)C)C(N[C@@H](CO)C(N[C@@H](CO)C(N[C@@H](CCC(O)=O)C(N[C@@H](C(C)C)C(N[C@@H](C(N[C@H]([C@@H](O)C)C(N[C@H](CCC(O)=O)C(N[C@H](C(C)C)C(O)=O)=O)=O)=O)C)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O
|
|
| MCULE-8755863060 |
0.82 |
CCCC(N1C(C(N2C[C@@H](C3C=CC=CC=3)[C@@H](C(=O)O)C2)=O)CCC1)=O
|
|
| MCULE-6130013345 |
0.82 |
CC(CC(N1C(C(N2C[C@@H](C3C=CC=CC=3)[C@@H](C(=O)O)C2)=O)CCC1)=O)(C)C
|
|
| MCULE-4615376925 |
0.82 |
C(N)C(NCC(N[C@H](CO)C(N[C@H](CC(C)C)C(N[C@@H](C(N[C@@H](CO)C(N[C@@H](C(NCC(N[C@@H](CC(C)C)C(N)=O)=O)=O)CC1C=CC=CC=1)=O)=O)CC1C=CC(O)=CC=1)=O)=O)=O)=O
|
|
| MCULE-4335664510 |
0.82 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(=O)[C@@H]1CCCO1)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-5601395786 |
0.82 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)CC1=CC=CC(OC)=C1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-9936281059 |
0.82 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(=O)[C@H]1CCCO1)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-2997361664 |
0.82 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(CC1=CC=CC(O)=C1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-5665322222 |
0.82 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)CC1C=C(F)C=CC=1C)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-7863410606 |
0.82 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CNCCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-7032722634 |
0.82 |
N1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C(C)C)NC(CN(C(C)=O)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-8228255768 |
0.82 |
C(=O)([C@@H]1CCCN1)N[C@@]([H])(CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-2901589869 |
0.82 |
C1C=C(CC(NC(=O)C2CCCN2)C(=O)O)C=CC=1
|
|
| MCULE-9756453464 |
0.82 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2C=CC=CC=2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(C)=O
|
|
| MCULE-9197777005 |
0.82 |
N1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C(C)C)NC(CN(C(=O)CNC(C)=O)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-3104877728 |
0.82 |
C1(=O)[C@@H](C(C)C)NC(CNCCNC([C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)=O
|
|
| MCULE-3440203403 |
0.82 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2C=CC=CC=2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(C(C)C)=O
|
|
| MCULE-3360761933 |
0.82 |
C(C)(C)[C@@H](C(N[C@H](CCCCN)C(N[C@@H](C(NCC(N[C@@H](C(C)C)C(NCC(N[C@@H](C(N[C@H](CCCCN)C(O)=O)=O)CC1C=CC=CC=1)=O)=O)=O)=O)CC1C=CC=CC=1)=O)=O)N
|
|
| MCULE-1867500360 |
0.82 |
CN1C(C(N[C@H]2[C@H](C3=CC=C(F)C=C3)C2)=O)(C)CC(O)C1
|
|
| MCULE-8393270792 |
0.82 |
N1(CCC(O)(C2C=CC=CC=2)C1)C(=O)CN1CCCCCC1=O
|
|
| MCULE-1407713396 |
0.82 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC(=O)[C@@H]1CCC(=O)N1
|
|
| MCULE-4591814098 |
0.82 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(=O)[C@@H]1CCC(=O)N1
|
|
| MCULE-2644354950 |
0.82 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC([C@H](C)O)=O
|
|
| MCULE-4117413913 |
0.82 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(=O)C1CCN(CC1)C
|
|
| MCULE-4162150271 |
0.82 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC(=O)C1CCN(CC1)C(C)=O
|
|
| MCULE-9815831821 |
0.82 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(=O)CN1CCCCC1=O
|
|
| MCULE-7830282747 |
0.82 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC([C@@H](C)O)=O
|
|
| MCULE-3476313275 |
0.82 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(=O)C1CC1
|
|
| MCULE-7497706384 |
0.82 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(=O)[C@H]1CCC(=O)N1
|
|
| MCULE-2082172374 |
0.82 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(C1CCC1)=O
|
|
| MCULE-9571780399 |
0.82 |
NC([C@H]1N(C(CCC2=CC=C(F)C=C2)=O)C[C@H](O)C1)=O
|
|
| MCULE-8198264100 |
0.82 |
CC(N1[C@@H](C(NCC2(C3=CC(Cl)=CC=C3)CC2)=O)C[C@@H](O)C1)=O
|
|
| MCULE-2392272196 |
0.82 |
CC(N1[C@@H](C(N2C(CC3=CC=C(F)C=C3)(C)CCC2)=O)C[C@H](O)C1)=O
|
|
| MCULE-5115439982 |
0.82 |
CN1C(=O)CCC1C(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O
|
|
| MCULE-6915087418 |
0.82 |
C(O)(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC1=CC=C(O)C=C1)N
|
|
| MolPort-039-218-276 |
0.82 |
OC1(CCN(C1)C(=O)CN1CCCCCC1=O)C1=CC=CC=C1
|
|
| MolPort-023-276-395 |
0.82 |
CC(C)[C@H](N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCCN)C(O)=O
|
|
| MolPort-019-939-034 |
0.82 |
CC(C)[C@H](N)C(=O)N[C@H](CCCCN)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)NCC(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@H](CCCCN)C(O)=O
|
|
| MolPort-045-915-434 |
0.82 |
CC(C)[C@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)C1CCC1
|
|
| MolPort-045-935-184 |
0.82 |
CC(C)[C@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)[C@@H](C)O
|
|
| MolPort-045-931-625 |
0.82 |
CC(C)[C@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)[C@@H]1CCC(=O)N1
|
|
| MolPort-045-932-952 |
0.82 |
CC(C)[C@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)[C@H]1CCC(=O)N1
|
|
| MolPort-045-917-897 |
0.82 |
CC(C)[C@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)C1CCN(CC1)C(C)=O
|
|
| MolPort-045-995-922 |
0.82 |
NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)CCC1=CC=C(F)C=C1
|
|
| MolPort-035-392-830 |
0.82 |
CC(=O)N1C[C@H](O)C[C@@H]1C(=O)NCC1(CC1)C1=CC=CC(Cl)=C1
|
|
| MolPort-040-831-647 |
0.82 |
CC(=O)N1C[C@@H](O)C[C@@H]1C(=O)N1CCCC1(C)CC1=CC=C(F)C=C1
|
|
| MolPort-042-361-654 |
0.82 |
CN1C(CCC1=O)C(=O)N[C@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-046-683-512 |
0.82 |
CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(C)C)C(O)=O
|
|
| MolPort-023-276-020 |
0.82 |
CC(C)C[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)[C@@H](CO)NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(=O)N[C@@H]([C@@H](C)O)C(O)=O
|
|
| MolPort-046-418-702 |
0.81 |
CC(C)C[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CN)C(=O)N[C@@H](CC(N)=O)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](C(C)C)C(=O)NCC(O)=O
|
|
| MolPort-046-132-170 |
0.81 |
CC(=O)N1CCC[C@H]1C(=O)N1C[C@@H](O)[C@H](CC2=CC=CC=C2)C1
|
|
| MolPort-045-934-842 |
0.81 |
CC[C@H](C)[C@@H]1NC(=O)CN(CC2=C(F)C=CC=C2)CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O
|
|
| MolPort-045-934-033 |
0.81 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)CCCC1=CNN=C1
|
|
| MolPort-045-934-479 |
0.81 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)C1=CC=C(CCN)C=C1
|
|
| MolPort-039-140-877 |
0.81 |
CC(C)C[C@H](N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-045-931-779 |
0.81 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2)NC1=O)[C@@H](C)O)C(=O)C1CC1
|
|
| MolPort-045-917-533 |
0.81 |
CC(C)[C@H]1NC(=O)CN(CC(N)=O)CCNC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2)NC1=O)[C@@H](C)O
|
|
| MolPort-039-293-751 |
0.81 |
OC(CNC(=O)C1CC(O)CN1)CC1=CC=CC=C1
|
|
| MolPort-019-939-104 |
0.81 |
C[C@@H](O)[C@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)NCC(=O)N[C@@H](C)C(O)=O
|
|
| MolPort-023-276-056 |
0.81 |
C[C@@H](O)[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)NCC(=O)N[C@@H](C)C(O)=O
|
|
| MolPort-046-418-758 |
0.81 |
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCC(N)=O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](C)C(O)=O
|
|
| MolPort-046-788-307 |
0.81 |
CC(O)=O.C[C@@H](O)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)CNC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCCN)C(O)=O
|
|
| MolPort-046-570-366 |
0.81 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)C1CC2=CC=CC=C2C1
|
|
| MolPort-002-200-148 |
0.81 |
CC(=O)NC(CC1=CC=CC=C1)C(=O)NC(CCC(O)=O)C(O)=O
|
|
| MolPort-045-915-024 |
0.81 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2)NC1=O)[C@@H](C)O)C(=O)C1CCN(C)CC1
|
|
| MCULE-8462803046 |
0.81 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(NC2CC(C3=CC=CC=C3)C2)=O)C1
|
|
| MCULE-6042498337 |
0.81 |
[C@@H](NC(=O)CN)(C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(=O)N)C(=O)NCC(=O)NCC(=O)NCC(=O)N[C@@H](C(C)C)C(=O)NCC(=O)O)CC1C=CC=CC=1
|
|
| MCULE-5133057683 |
0.81 |
CC(N1[C@H](C(N2C[C@@H](CC3=CC=CC=C3)[C@H](O)C2)=O)CCC1)=O
|
|
| MCULE-6486934836 |
0.81 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(CC1=CC=CC=C1F)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-8795542683 |
0.81 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)C1C=CC(=CC=1)CCN)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-5240605155 |
0.81 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(CCCC1C=NNC=1)=O)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-8499310221 |
0.81 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(=O)C1(CCC1)COC
|
|
| MCULE-8498418454 |
0.81 |
O=C([C@@H]1CCCN1C([C@H](CCC/N=C(\N)/N)N)=O)N1CCC[C@H]1C(NCC(N[C@@H](CC1=CC=CC=C1)C(N[C@@H](CO)C(N1CCC[C@H]1C(N[C@H](C(=O)O)CC1=CC=CC=C1)=O)=O)=O)=O)=O
|
|
| MCULE-4038789041 |
0.81 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(CC(N)=O)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-8278312322 |
0.81 |
OC(CC1C=CC=CC=1)CNC(C1NCC(O)C1)=O
|
|
| MCULE-2801415557 |
0.81 |
C(C1C=CC=CC=1)[C@H](N)C(NCC(NCC(N[C@@H](C(N[C@@H]([C@H](O)C)C(NCC(N[C@H](C(O)=O)C)=O)=O)=O)CC1C=CC=CC=1)=O)=O)=O
|
|
| MCULE-6165751603 |
0.81 |
N1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C(C)C)NC(CN(C(=O)C2CC2)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-8618259726 |
0.81 |
CN1C(C(NCCC(C2=CC=CC=C2)O)=O)(C)CC(O)C1
|
|
| MCULE-5581096425 |
0.81 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(=O)C1(C)CC1
|
|
| MCULE-8161139065 |
0.81 |
O=C(CNC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC1C=CC(O)=CC=1)CC1C=CC=CC=1)O
|
|
| MCULE-6288736507 |
0.81 |
C(N[C@@H](CCCCN)C(N[C@@H](CC(C)C)C(N[C@@H](C(C)C)C(N[C@@H](CC1=CC=CC=C1)C(N[C@@H](CC1=CC=CC=C1)C(N[C@@H](C)C(O)=O)=O)=O)=O)=O)=O)([C@H](CCC(N)=O)N)=O
|
|
| MCULE-9075525573 |
0.81 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)C1CC3=C(C=CC=C3)C1)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
|
|
| MCULE-4688906675 |
0.81 |
N1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C(C)C)NC(CN(C(=O)C2CCN(CC2)C)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-6665586398 |
0.81 |
C(=O)(C(CC1C=CC=CC=1)NC(C)=O)NC(CCC(O)=O)C(O)=O
|
|
| MCULE-2453356137 |
0.81 |
C1=CC=CC(CC(C(=O)NC(C(C)C)C(O)=O)NC(=O)C)=C1
|
|
| MCULE-3091653299 |
0.81 |
OC1CC(C(N2CCC(C3C=CC=CC=3)CC2)=O)NC1
|
|
| MCULE-3599415739 |
0.81 |
N12CCC[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C2=O
|
|
| MCULE-5342032561 |
0.81 |
N12CCC[C@H]1C(=O)N[C@H](CC1C=CC=CC=1)C2=O
|
|
| MCULE-8013779869 |
0.81 |
N12CCC[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C2=O
|
|
| MCULE-4394434028 |
0.81 |
CC(C1=CC=CC=C1)CNC(C1(N(C)CC(O)C1)C)=O
|
|
| MCULE-5108475207 |
0.81 |
N12CCCC1C(=O)NC(CC1C=CC=CC=1)C2=O
|
|
| MCULE-2848973662 |
0.81 |
C1C=C(C[C@@H]2C(=O)N3CCC[C@@]3([H])C(=O)N2)C=CC=1
|
|
| MolPort-014-497-724 |
0.81 |
OC1CNC(C1)C(=O)N1CCC(CC1)C1=CC=CC=C1
|
|
| MolPort-001-739-299 |
0.81 |
CC(C)C(NC(=O)C(CC1=CC=CC=C1)NC(C)=O)C(O)=O
|
|
| MolPort-046-689-305 |
0.81 |
OC(=O)C(F)(F)F.C[C@@H](NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCC(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(N)=O
|
|
| MolPort-000-134-526 |
0.81 |
O=C1N[C@@H](CC2=CC=CC=C2)C(=O)N2CCC[C@@H]12
|
|
| MolPort-000-134-527 |
0.81 |
O=C1N[C@H](CC2=CC=CC=C2)C(=O)N2CCC[C@@H]12
|
|
| MolPort-000-856-237 |
0.81 |
O=C1NC(CC2=CC=CC=C2)C(=O)N2CCCC12
|
|
| MolPort-046-567-739 |
0.80 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CCNC(C)=O
|
|
| MolPort-045-936-484 |
0.80 |
COCCC(=O)N[C@H]1C[C@@H]2N(C1)C(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](NC(=O)CN(C)C(=O)[C@H](CO)NC2=O)C(C)C
|
|
| MolPort-045-917-739 |
0.80 |
COCC(C)(C)C(=O)N[C@H]1C[C@@H]2N(C1)C(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](NC(=O)CN(C)C(=O)[C@H](CO)NC2=O)C(C)C
|
|
| MolPort-027-861-640 |
0.80 |
OC(=O)[C@@H]1CN(C[C@H]1C1=CC=CC=C1)C(=O)CN1CCCCC1=O
|
|
| MolPort-046-418-739 |
0.80 |
CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(C)C)C(O)=O
|
|
| MolPort-039-085-484 |
0.80 |
CC1(C)CN(CC1O)C(=O)C1CCCN1C(=O)CC1=CC=CC=C1
|
|
| MolPort-042-640-290 |
0.80 |
CC(=O)NC(C)(C)C(=O)N1CCC(O)(C1)C1=CC=CC=C1
|
|
| MCULE-6577204597 |
0.80 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2C=CC=CC=2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(=O)[C@H](C)C1C=CC=CC=1
|
|
| MCULE-9654279599 |
0.80 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2C=CC=CC=2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(=O)CCOC
|
|
| MCULE-4756023438 |
0.80 |
C(=O)(N[C@@H](C)CO)[C@@H](CC1C=CC=CC=1)NC(=O)[C@@H]1CC[C@H](CC1)C(C)C
|
|
| MCULE-3855283235 |
0.80 |
CCCC(C(NC(C(=O)O)CC1C=CC=CC=1)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-5740404813 |
0.80 |
CC(NC(C1NCC(O)C1)=O)CC1=C(C)C=CC=C1
|
|
| MCULE-8656314512 |
0.80 |
N1(C[C@H]([C@H](C(O)=O)C1)C1C=CC=CC=1)C(=O)CN1CCCCC1=O
|
|
| MCULE-9797821199 |
0.80 |
C(O)(=O)[C@H]([C@@H](C)CC)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C(C)C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC1=CC=C(O)C=C1)N
|
|
| MCULE-8163887939 |
0.80 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)CCNC(C)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-5835101292 |
0.80 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC(=O)C(C)(C)COC
|
|
| MCULE-5716524591 |
0.80 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC(=O)CCOC
|
|
| MCULE-4715351553 |
0.80 |
N1(C[C@@H]2C[C@@H](CN2C(=O)[C@@H]1CC1C=CC=CC=1)OC)C(NC)=O
|
|
| MCULE-1173970231 |
0.80 |
CN1C(C(NCC(C2=CC=CC=C2)O)=O)(C)CC(O)C1
|
|
| MCULE-6959645423 |
0.80 |
CC1(C(O)CN(C(C2N(C(CC3=CC=CC=C3)=O)CCC2)=O)C1)C
|
|
| MCULE-8811189762 |
0.80 |
N1(CCC(O)(C2C=CC=CC=2)C1)C(=O)C(C)(C)NC(C)=O
|
|
| MCULE-9567180664 |
0.80 |
OC([C@H](NC(CN1C(=O)CCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-6245849804 |
0.80 |
CN(C(C1(N(C)CC(O)C1)C)=O)CC(C1=CC=CC=C1)(O)C
|
|
| MCULE-8848455960 |
0.80 |
CC(CCC(NCC(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)=O)C
|
|
| MCULE-1272073009 |
0.80 |
N12CCC[C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CN(C(COC)=O)CC(=O)N[C@@H](C)C2=O)CC1C=CC=CC=1
|
|
| MCULE-4230699511 |
0.80 |
C(N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@H](C(=O)O)CC(C)C)CC1C=CC(O)=CC=1)(=O)[C@H]([C@@H](C)CC)NC(=O)[C@@H](N)CCCCN
|
|
| MCULE-7038033361 |
0.80 |
C(CCCN)[C@@H](C(N[C@H](C(N1[C@H](CCC1)C(N[C@@H](C(N[C@H](C(N[C@@H](CC(C)C)C(O)=O)=O)[C@H](C)CC)=O)CC1C=CC(O)=CC=1)=O)=O)[C@H](C)CC)=O)N
|
|
| MCULE-8549603200 |
0.80 |
CC(C(C(N1CC(C)(C)C(C2=CC=CC=C2)C1)=O)NC(C1CC1)=O)O
|
|
| MCULE-9861045980 |
0.80 |
OCC(CC1C=CC=CC=1)NC(=O)C1CCCN1C(=O)C(C)(C)NC(=O)C(CC(C)C)NC(=O)C(C)(C)NC(=O)C(CCC(N)=O)NC(=O)C(CC(C)C)NC(=O)C(C)(C)NC(=O)C(CC(C)C)NC(=O)C(C)(C)NC(=O)C(C(C)O)NC(=O)C(CC(C)C)NC(=O)C(C(C)C)NC(=O)C(CCC(O)=O)NC(=O)C(C(C)C)NC(=O)C(CCC(O)=O)NC(=O)C(C)NC(C)=O
|
|
| MCULE-6215165373 |
0.80 |
C(=O)(C(CC1C=CC=CC=1)NC(C)=O)NC(CC1=CC=CC=C1)C(O)=O
|
|
| MCULE-1999582178 |
0.80 |
O=C([C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CC(=O)O)CC1C=CC=CC=1)CCC(=O)O)CCC(=O)O)[C@H](CC)C)CCC(=O)O)CC1C=CC(O)=CC=1)CC(C)C)CCC(=O)N)O
|
|
| MCULE-3821448918 |
0.80 |
O=C([C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(=O)O)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)C)CC(=O)O)CC1C=CC=CC=1)CCC(=O)O)CCC(=O)O)[C@H](CC)C)CCC(=O)O)CC1C=CC(O)=CC=1)CC(C)C)CCC(=O)N)O
|
|
| MCULE-5569672495 |
0.80 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(C1CCOCC1)=O
|
|
| MCULE-9551176595 |
0.80 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(C(C2CCOCC2)=O)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-1147628533 |
0.80 |
C([C@H]1NC(=O)[C@H](CCN)NC(=O)[C@@]([H])(NC(=O)[C@H](CCN)NC(=O)[C@@H](N)[C@H](O)C)CCNC(=O)[C@]([H])([C@H](O)C)NC(=O)[C@H](CCN)NC(=O)[C@]([H])(CCN)NC(=O)[C@H](CC(C)C)NC1=O)C1C=CC=CC=1
|
|
| MCULE-2636726607 |
0.80 |
CN1C(C(NCC2(C3=C(C)C=CC=C3)CC2)=O)(C)CC(O)C1
|
|
| MCULE-5689703340 |
0.80 |
CC(C(=O)O)NC(C(NC(C12CC3CC(C1)CC(C3)C2)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-3866772169 |
0.80 |
CN(C(C1NCC(O)C1)=O)CCC1C=CC=C2C=1C=CC=C2
|
|
| MCULE-8502871517 |
0.80 |
N1(C[C@@H]2C[C@@H](CN2C(=O)[C@@H]1CC1C=CC=CC=1)OC)C(=O)NC(C)C
|
|
| MCULE-8930881957 |
0.80 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC(C1CCOCC1)=O
|
|
| MCULE-9287769626 |
0.80 |
N1(C[C@@H]2C[C@@H](CN2C(=O)[C@@H]1CC1C=CC=CC=1)OC)C(NCCC1C=CC=CC=1)=O
|
|
| MCULE-2563196438 |
0.80 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(C1CCOCC1)=O
|
|
| MCULE-5909636243 |
0.80 |
N1(C[C@@H]2C[C@@H](CN2C(=O)[C@@H]1CC1C=CC=CC=1)OC)C(NCC)=O
|
|
| MCULE-7741793219 |
0.80 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)CCN1CCCCCC1=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
|
|
| MCULE-1517014158 |
0.80 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(C1CCCC1)=O
|
|
| MCULE-5961567100 |
0.80 |
N1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C(C)C)NC(CN(C[C@@H]2CCCN3CCCC[C@@]32[H])CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-8638565874 |
0.80 |
CN1C(C(NC2C(C3=CC(F)=CC=C3)C2)=O)(C)CC(O)C1
|
|
| MCULE-7050603482 |
0.80 |
N12CCC[C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CN(C(=O)CCOC)CC(=O)N[C@@H](C)C2=O)CC1=CC=CC=C1
|
|
| MCULE-1609997437 |
0.80 |
C(=O)(N[C@@H](C)CO)[C@H](CC1C=CC=CC=1)NC(=O)C1CCC(CC1)C(C)C
|
|
| MCULE-5087805104 |
0.80 |
C(=O)(NC(C)CO)C(CC1C=CC=CC=1)NC(=O)C1CCC(CC1)C(C)C
|
|
| MolPort-035-786-613 |
0.80 |
CC(O)C(NC(=O)C1CC1)C(=O)N1CC(C2=CC=CC=C2)C(C)(C)C1
|
|
| MolPort-023-276-302 |
0.80 |
CC[C@H](C)[C@H](NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCCN)NC[C@@H](N)CCCCN)C(=O)N[C@@H](CC(C)C)C(O)=O
|
|
| MolPort-002-316-978 |
0.80 |
CC(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-023-276-260 |
0.80 |
CC[C@H](C)[C@H](NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)[C@@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)=O
|
|
| MolPort-046-569-609 |
0.80 |
COCC(=O)N1C[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](C)NC(=O)C1)C(C)C
|
|
| MolPort-039-055-596 |
0.80 |
CC(C)CC(NC(=O)C(NC(=O)C(CCC(O)=O)NC(=O)C(NC(=O)C(CCC(O)=O)NC(=O)C(C)NC(C)=O)C(C)C)C(C)C)C(=O)NC(C(C)O)C(=O)NC(C)(C)C(=O)NC(CC(C)C)C(=O)NC(C)(C)C(=O)NC(CC(C)C)C(=O)NC(CCC(N)=O)C(=O)NC(C)(C)C(=O)NC(CC(C)C)C(=O)NC(C)(C)C(=O)N1CCCC1C(=O)NC(CO)CC1=CC=CC=C1
|
|
| MolPort-019-939-090 |
0.80 |
CC[C@@H](C)[C@H](NC(=O)[C@@H](CC1=CC=C(O)C=C1)NC(=O)[C@H]1CCCN1C(=O)[C@@H](NC(=O)[C@@H](N)CCCCN)[C@H](C)CC)C(=O)N[C@@H](CC(C)C)C(O)=O
|
|
| MolPort-044-649-462 |
0.80 |
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(O)=O)NC(C)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(O)=O
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| MolPort-045-916-257 |
0.80 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2)NC1=O)[C@@H](C)O)C(=O)CC12CC3CC(CC(O)(C3)C1)C2
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|
| MolPort-046-697-025 |
0.80 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCN)NC(=O)[C@H](CCNC(=O)[C@@H](NC(=O)[C@H](CCN)NC(=O)[C@H](CCN)NC1=O)[C@@H](C)O)NC(=O)[C@H](CCN)NC(=O)[C@@H](N)[C@@H](C)O
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| MolPort-044-639-121 |
0.80 |
CCNC(=O)N1C[C@@H]2C[C@@H](CN2C(=O)[C@@H]1CC1=CC=CC=C1)OC
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|
| MolPort-045-932-324 |
0.80 |
CC(C)C[C@@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)C1CCCC1
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|
| MolPort-044-639-149 |
0.80 |
CO[C@H]1C[C@H]2CN([C@@H](CC3=CC=CC=C3)C(=O)N2C1)C(=O)NCCC1=CC=CC=C1
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|
| MolPort-046-569-708 |
0.80 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CCN1CCCCCC1=O
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| MolPort-045-918-959 |
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CC(C)[C@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)C1CCOCC1
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| MolPort-045-934-311 |
0.80 |
CC(C)C[C@@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)C1CCOCC1
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| MolPort-044-639-131 |
0.80 |
CO[C@H]1C[C@H]2CN([C@@H](CC3=CC=CC=C3)C(=O)N2C1)C(=O)NC(C)C
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|
| MolPort-045-931-770 |
0.80 |
CC(C)[C@H]1NC(=O)CN(C[C@@H]2CCCN3CCCC[C@H]23)CCNC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2)NC1=O)[C@@H](C)O
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| MolPort-045-918-642 |
0.80 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC1=O)C(=O)[C@H](C)C1=CC=CC=C1
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| MolPort-045-937-579 |
0.80 |
COCCC(=O)N1CCNC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](NC(=O)C1)C(C)C
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| MolPort-014-475-557 |
0.80 |
CC(CC1=C(C)C=CC=C1)NC(=O)C1CC(O)CN1
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| MolPort-039-347-795 |
0.80 |
CC(C)C1CCC(CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](C)CO
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| MolPort-039-060-009 |
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CC(C)[C@H]1CC[C@@H](CC1)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](C)CO
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| MolPort-046-570-356 |
0.80 |
COCCC(=O)N1C[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](C)NC(=O)C1)C(C)C
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|
| MolPort-045-983-469 |
0.79 |
CC(CC1=CC=CC=C1C(F)(F)F)NC(=O)[C@H]1C[C@H](O)CN1C(C)=O
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|
| MolPort-046-162-719 |
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CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](N)CCCCN)[C@@H](C)CC)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCCN)C(O)=O
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|
| MolPort-044-458-278 |
0.79 |
CC(=O)N1C[C@@H](O)C[C@@H]1C(=O)NCC1(CC1)C1=CC=C(F)C=C1F
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|
| MolPort-045-946-665 |
0.79 |
NC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
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| MolPort-046-568-168 |
0.79 |
COCC(=O)N[C@H]1CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC(=O)[C@H](NC1=O)C(C)C
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|
| MolPort-002-200-179 |
0.79 |
CC(C)CC(NC(=O)C(CC1=CC=C(F)C=C1)NC(C)=O)C(O)=O
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|
| MolPort-046-738-967 |
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O[C@H](C1CCCCC1)C(=O)N1C[C@H](CC2=CC=CC=C2)NC(=O)C1
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|
| MolPort-006-120-076 |
0.79 |
NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
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|
| MolPort-012-238-439 |
0.79 |
N[C@@H](CC1=CC=CC=C1)C(=O)N1CCC[C@H]1C(O)=O
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|
| MolPort-046-682-692 |
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O=C1NCCNC1=O.CC(C)C[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(O)=O
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|
| MolPort-023-276-628 |
0.79 |
N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
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|
| MolPort-023-276-710 |
0.79 |
CNCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@H](CC1=CC=CC=C1)C(O)=O
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|
| MolPort-046-683-493 |
0.79 |
CC(O)=O.N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
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|
| MolPort-044-463-200 |
0.79 |
COC1(CN(C1)C(=O)[C@H]1C[C@H](O)CN1C(C)=O)C1=CC=CC=C1
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|
| MolPort-046-567-310 |
0.79 |
CC[C@H]1CN(CC(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N1)C(=O)COC
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|
| MolPort-046-570-230 |
0.79 |
COCCC(=O)N[C@H]1CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC(=O)[C@H](NC1=O)C(C)C
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|
| MolPort-039-235-308 |
0.79 |
OC1CNC(C1)C(=O)NCC1(CC1)C1=CC=C(F)C=C1
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|
| MolPort-046-426-262 |
0.79 |
CC(C)C[C@H](NC(=O)CNC(=O)C(C)(C)NC(=O)[C@@H](NC(=O)C(C)(C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(C)NC(=O)[C@H](C)NC(=O)C(C)(C)NC(=O)[C@@H]1CCCN1C(=O)C(C)(C)NC(C)=O)C(C)C)C(=O)NC(C)(C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@H](CCC(N)=O)C(=O)N[C@H](CO)CC1=CC=CC=C1
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|
| MCULE-1694960988 |
0.79 |
CC(N1[C@@H](C(NCC2(C3=C(F)C=C(F)C=C3)CC2)=O)C[C@H](O)C1)=O
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|
| MCULE-1364937763 |
0.79 |
N1(CCC[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(O)=O)C(N)=O
|
|
| MCULE-6254438242 |
0.79 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(COC)=O)C
|
|
| MCULE-8241012890 |
0.79 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(NCC2CC3=C(C=CC=C3)C2)=O)C1
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|
| MCULE-3300542029 |
0.79 |
N1(C[C@H](CC2C=CC=CC=2)NC(=O)C1)C(=O)[C@H](O)C1CCCCC1
|
|
| MCULE-5577872095 |
0.79 |
C(=O)(C(CC1C=CC(=CC=1)F)NC(C)=O)NC(CC(C)C)C(O)=O
|
|
| MCULE-6036534836 |
0.79 |
CN1C(C(NC2CC(C3=CC=CC=C3)C2)=O)(C)CC(O)C1
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|
| MCULE-6392222135 |
0.79 |
C(N1CCCC1C(O)=O)(=O)C(N)CC1C=CC=CC=1
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|
| MCULE-1097713848 |
0.79 |
N1(CCC[C@H]1C(=O)O)C(=O)[C@@H](N)CC1C=CC=CC=1
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|
| MCULE-5094374641 |
0.79 |
OC1CC(C(N2CC(CC3C=CC=CC=3)CC2)=O)NC1
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|
| MCULE-9914176578 |
0.79 |
C(N1CCC[C@H]1C(N1CCC[C@H]1C(NCC(N[C@@H](CC1=CC=CC=C1)C(N[C@@H](CO)C(N1CCC[C@H]1C(N[C@@H](CC1=CC=CC=C1)C(O)=O)=O)=O)=O)=O)=O)=O)([C@H](CCCNC(N)=N)N)=O.OC(C)=O
|
|
| MCULE-2541623493 |
0.79 |
COC1(C2=CC=CC=C2)CN(C([C@@H]2N(C(C)=O)C[C@@H](O)C2)=O)C1
|
|
| MCULE-6106405963 |
0.79 |
OC1CC(C(NCC2(C3=CC=C(F)C=C3)CC2)=O)NC1
|
|
| MCULE-6450897111 |
0.79 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(=O)CCOC)C
|
|
| MCULE-6420101409 |
0.79 |
N1(C[C@H](CC)NC(=O)[C@H](CC2=CC=CC=C2)NC([C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C1)=O)C(COC)=O
|
|
| MCULE-8655364834 |
0.79 |
CN1C(C(NCC(C2=CC(C)=CC=C2)(C)C)=O)(C)CC(O)C1
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|
| MCULE-2824449950 |
0.79 |
CN1C(C(NCCC2=CC=C(C(C)(C)C)C=C2)=O)(C)CC(O)C1
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|
| MCULE-3054444069 |
0.79 |
CC([C@H](C(NC(C(N1CCN(C)CC1)=O)CC1=CC=CC=C1)=O)O)C
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|
| MCULE-2755720834 |
0.79 |
CNC(C(N[C@@H](C(O)=O)CC1=CC=CC=C1)=O)CC(C)(C)C
|
|
| MCULE-2150729135 |
0.79 |
Cl.CN(C(C1NCC(O)C1)=O)CCC1C=CC=C2C=1C=CC=C2
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|
| MCULE-3532570069 |
0.79 |
CC(CCC(NCC(NC(C(=O)O)CC1C=CC=CC=1)=O)=O)C
|
|
| MCULE-6259239858 |
0.79 |
CC(CCC(NCC(N(C(C(=O)O)CC1C=CC=CC=1)C)=O)=O)C
|
|
| MCULE-4527204164 |
0.79 |
CC(C1=CC=C(CCNC(C2(N(C)CC(O)C2)C)=O)C=C1)C
|
|
| MCULE-8007512999 |
0.79 |
CC(CCC(NCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)=O)C
|
|
| MCULE-2471544211 |
0.79 |
CCC1=CC=C(C(CNC(C2(N(C)CC(O)C2)C)=O)(C)C)C=C1
|
|
| MCULE-3749159355 |
0.79 |
NC(C1N(CC(NCCC2=CC=CC=C2)=O)CC(O)C1)=O
|
|
| MCULE-2199770977 |
0.79 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(CCC1CCC1)=O
|
|
| MCULE-6065628824 |
0.79 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(C1CCCCCC1)=O
|
|
| MCULE-4261221387 |
0.79 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)C1CCN(CC1)C(COC)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-1683452578 |
0.79 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC(=O)CCN1CCCCC1=O
|
|
| MCULE-3560412105 |
0.79 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(CCC(F)(F)F)=O
|
|
| MCULE-2842007929 |
0.79 |
CN(C(C(NC(C12CC3CC(CC(C3)C1)C2)=O)CC1=CC=CC=C1)=O)CC(O)=O
|
|
| MCULE-8438289475 |
0.79 |
OC(CNC(C(NC(C12CC3CC(C1)CC(C3)C2)=O)CC1C=CC=CC=1)=O)=O
|
|
| MCULE-4500633617 |
0.79 |
CCCC(N1C(C(NC(C(=O)O)CC2C=CC=CC=2)=O)CCCC1)=O
|
|
| MCULE-6320356430 |
0.79 |
N1(CC(=O)NC2(CCCC2)CO)CC(CC1=O)C1C=CC=CC=1
|
|
| MCULE-8672257085 |
0.79 |
[C@@H](NC(=O)[C@@H](N)CC(=O)O)(C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](C(=O)O)CCCCN)CC1C=CC(O)=CC=1
|
|
| MCULE-2725185489 |
0.79 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)NCCN(C(=O)[C@@H]2CCCN2)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-5927002851 |
0.79 |
C(=O)(N[C@@H](CO)CC1C=CC=CC=1)[C@@H]1CCCN1C
|
|
| MCULE-1716013601 |
0.79 |
CCC(C1NC(=O)C2N(CCC2)C(=O)C2N(CCC2)C(=O)C2N(CCC2)C(=O)C(CC(C)C)NC(=O)CNC(=O)CNC(=O)C(CC2C=CC=CC=2)NC1=O)C
|
|
| MCULE-3500387807 |
0.79 |
O=C1N2[C@@](C(=O)N3[C@@](C(=O)N[C@]([C@H](CC)C)([H])C(=O)N[C@@H](CC4C=CC=CC=4)C(=O)NCC(=O)NCC(=O)N[C@](CC(C)C)([H])C(=O)N4CCC[C@@]14[H])([H])CCC3)([H])CCC2
|
|
| MCULE-9689951490 |
0.79 |
CO[C@@H]1CN(C(CCC2=CC3=C(C=CC=C3)C=C2)=O)[C@H](C(N)=O)C1
|
|
| MCULE-5610279953 |
0.79 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)CN1CCOC1=O)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-9219663457 |
0.79 |
N1(C[C@H](CC)NC(=O)[C@H](CC2C=CC=CC=2)NC([C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C1)=O)C(=O)CCOC
|
|
| MCULE-9529491654 |
0.79 |
CC1C=CC(C(CNC(C2NCC(O)C2)=O)O)=CC=1
|
|
| MCULE-7131255188 |
0.79 |
CN1C(C(NC[C@H](C2=CC=C(C)C=C2)O)=O)(C)CC(O)C1
|
|
| MCULE-7727575212 |
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C(C1C=CC(O)=CC=1)[C@H](N)C(N1[C@@H](CCC1)C(N[C@H](CCC(N)=O)C(N1[C@@H](CCC1)C(N[C@@H](CCC(N)=O)C(N1[C@H](CCC1)C(N[C@@H](C(O)=O)CC1C=CC=CC=1)=O)=O)=O)=O)=O)=O
|
|
| MCULE-7143383595 |
0.79 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(CCNC(=O)[C@@H]1[C@@H](C)O)C(=O)[C@@H]1CCCN2CCCC[C@]12[H])=O
|
|
| MolPort-038-998-054 |
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Cl.CN(CCC1=CC=CC2=CC=CC=C12)C(=O)C1CC(O)CN1
|
|
| MolPort-019-643-157 |
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NC(=O)C1CC(O)CN1CC(=O)NCCC1=CC=CC=C1
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|
| MolPort-046-122-076 |
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CC(C)[C@@H](O)C(=O)NC(CC1=CC=CC=C1)C(=O)N1CCN(C)CC1
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|
| MolPort-044-537-872 |
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CNC(CC(C)(C)C)C(=O)N[C@H](CC1=CC=CC=C1)C(O)=O
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|
| MolPort-045-934-747 |
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CC(C)[C@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)CCC(F)(F)F
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|
| MolPort-045-939-024 |
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CC(C)[C@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)CCN1CCCCC1=O
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|
| MolPort-045-934-691 |
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CC(C)[C@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)CCC1CCC1
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|
| MolPort-045-916-187 |
0.79 |
CC(C)C[C@@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)C1CCCCCC1
|
|
| MolPort-046-568-070 |
0.79 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)C1CCN(CC1)C(=O)COC
|
|
| MolPort-029-888-657 |
0.79 |
OCC1(CCCC1)NC(=O)CN1CC(CC1=O)C1=CC=CC=C1
|
|
| MolPort-046-702-227 |
0.79 |
NCCCCC(NC(=O)C(CC(O)=O)NC(=O)C(CC(O)=O)NC(=O)C(CC(O)=O)NC(=O)C(CC(O)=O)NC(=O)C(CCCCN)NC(=O)C(CC1=CC=C(O)C=C1)NC(=O)C(N)CC(O)=O)C(O)=O
|
|
| MolPort-046-418-699 |
0.79 |
NCCCC[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@@H](N)CC(O)=O)C(O)=O
|
|
| MolPort-039-339-150 |
0.79 |
CCC(C)[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@@H]2CCCN2C(=O)[C@H](CC(C)C)NC(=O)CNC(=O)CNC(=O)[C@@H](CC2=CC=CC=C2)NC1=O
|
|
| MolPort-045-958-109 |
0.79 |
CN1CCC[C@H]1C(=O)N[C@@H](CO)CC1=CC=CC=C1
|
|
| MolPort-046-594-331 |
0.79 |
CCC(C)C1NC(=O)C2CCCN2C(=O)C2CCCN2C(=O)C2CCCN2C(=O)C(CC(C)C)NC(=O)CNC(=O)CNC(=O)C(CC2=CC=CC=C2)NC1=O
|
|
| MolPort-044-439-604 |
0.79 |
CO[C@H]1C[C@H](N(C1)C(=O)CCC1=CC2=CC=CC=C2C=C1)C(N)=O
|
|
| MolPort-045-917-847 |
0.79 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)CN1CCOC1=O
|
|
| MolPort-039-293-764 |
0.79 |
CC1=CC=C(C=C1)C(O)CNC(=O)C1CC(O)CN1
|
|
| MolPort-046-568-297 |
0.79 |
CC[C@H]1CN(CC(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N1)C(=O)CCOC
|
|
| MolPort-023-277-062 |
0.79 |
CC(C)C[C@H](N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(O)=O)C(N)=O
|
|
| MolPort-019-939-250 |
0.79 |
N[C@@H](CC1=CC=C(O)C=C1)C(=O)N1CCC[C@H]1C(=O)N[C@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N1CCC[C@@H]1C(=O)N[C@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-023-276-708 |
0.78 |
CCCC[C@H](NC(=O)[C@H](CC(C)C)N(C)C(=O)CNC(=O)[C@@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CC(O)=O)C(C)C)C(N)=O
|
|
| MolPort-039-063-119 |
0.78 |
CC(O)=O.N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O
|
|
| MolPort-003-926-907 |
0.78 |
N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O
|
|
| MolPort-046-418-743 |
0.78 |
NC(=N)NCCC[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1)C(O)=O
|
|
| MolPort-046-144-901 |
0.78 |
OC1CCCN(C1)C(=O)C1CCCN1C(=O)CC1=CC=CC=C1
|
|
| MolPort-035-766-352 |
0.78 |
N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(O)=O
|
|
| MolPort-039-293-650 |
0.78 |
Cl.OC1CNC(C1)C(=O)N1CCC(CC2=CC=CC=C2)C1
|
|
| MolPort-027-853-491 |
0.78 |
CNC(=O)[C@@H](CC1=CC=CC=C1)N1CCC[C@H]1C(O)=O
|
|
| MolPort-023-276-709 |
0.78 |
N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@H](CN[C@@H](CCCNC(N)=N)C(O)=O)CC1=CC=CC=C1
|
|
| MolPort-046-162-756 |
0.78 |
N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CO)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(O)=O
|
|
| MolPort-046-451-551 |
0.78 |
CC(=O)N1C[C@@H](O)C[C@@H]1C(=O)N1CCC(CCC2=CC=C(C)C=C2)CC1
|
|
| MolPort-045-931-860 |
0.78 |
COCC(=O)N1CCNC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@H](NC(=O)C1)C(C)C
|
|
| MolPort-027-883-154 |
0.78 |
O[C@@H]1CN[C@H](C1)C(=O)N1CCCC(C1)(C1=CC=CC=C1)C1=CC=CC=C1
|
|
| MolPort-045-915-603 |
0.78 |
COCC(=O)N1CCNC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](NC(=O)C1)C(C)C)[C@@H](C)O
|
|
| MolPort-046-568-799 |
0.78 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CC1=CC=C(C=C1)C1=CC=CC=C1
|
|
| MolPort-045-932-190 |
0.78 |
COCC(=O)N[C@H]1C[C@@H]2N(C1)C(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](NC(=O)CN(C)C(=O)[C@H](CO)NC2=O)C(C)C
|
|
| MolPort-045-917-241 |
0.78 |
COC(C)(C)C(=O)N[C@H]1C[C@@H]2N(C1)C(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](NC(=O)CN(C)C(=O)[C@H](CO)NC2=O)C(C)C
|
|
| MolPort-042-643-041 |
0.78 |
CC(C)(N1CCCC1)C(=O)N1CCC(O)(C1)C1=CC=CC=C1
|
|
| MolPort-001-828-127 |
0.78 |
CC(C)CC(N)C(=O)NCC(=O)NC(CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-045-993-377 |
0.78 |
CC1CCN(C1C)C(=O)C1CC(O)CN1C(=O)CC1=CC=CC=C1F
|
|
| MolPort-045-993-378 |
0.78 |
CCN(CC)C(=O)C1CC(O)CN1C(=O)CC1=CC=CC=C1F
|
|
| MCULE-5644057262 |
0.78 |
OC[C@@H]1N(C(CCC2=CC=CC=C2)=O)C[C@H]2N(CCC2)C1
|
|
| MCULE-5195824681 |
0.78 |
CC(C1=CC=CC=C1)CC(N1[C@@H](CO)CN2[C@@H](CCC2)C1)=O
|
|
| MCULE-7396549364 |
0.78 |
C(CCNC(N)=N)[C@H](C(N1[C@H](CCC1)C(N1[C@H](CCC1)C(NCC(N[C@@H](C(N[C@@H](CO)C(N1[C@H](CCC1)C(N[C@H](C(N[C@@H](CCCNC(N)=N)C(O)=O)=O)CC1C=CC=CC=1)=O)=O)=O)CC1C=CC=CC=1)=O)=O)=O)=O)N
|
|
| MCULE-1634176224 |
0.78 |
C([C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(N)=N)(N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CCCNC(N)=N)CC1C=CC=CC=1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-3162298750 |
0.78 |
C(N1CCC[C@H]1C(NCC(N[C@@H](CC1=CC=CC=C1)C(N[C@@H](CO)C(N1CCC[C@H]1C(N[C@@H](CC1=CC=CC=C1)C(N[C@@H](CCCNC(N)=N)C(O)=O)=O)=O)=O)=O)=O)=O)([C@@H]1CCCN1)=O
|
|
| MCULE-8156212650 |
0.78 |
O=C(O)[C@@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CC1C=CC=CC=1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)N
|
|
| MCULE-1683739846 |
0.78 |
C(N1CCC[C@H]1C(N1CCC[C@H]1C(NCC(N[C@@H](CC1=CC=CC=C1)C(N[C@@H](CO)C(N1CCC[C@H]1C(O)=O)=O)=O)=O)=O)=O)([C@H](CCCNC(N)=N)N)=O
|
|
| MCULE-8796027498 |
0.78 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(=O)C1(CCC1)COC
|
|
| MCULE-2806770831 |
0.78 |
C(N1CCC[C@H]1C(NCC(N[C@@H](CC1=CC=CC=C1)C(N[C@@H](CO)C(N1CCC[C@H]1C(N[C@@H](CC1=CC=CC=C1)C(N[C@@H](CCCNC(N)=N)C(O)=O)=O)=O)=O)=O)=O)=O)([C@H]1NCCC1)=O
|
|
| MCULE-1375740755 |
0.78 |
Cl.OC1CC(C(N2CC(CC3C=CC=CC=3)CC2)=O)NC1
|
|
| MCULE-8438265775 |
0.78 |
OC1CN(C(C2N(C(CC3=CC=CC=C3)=O)CCC2)=O)CCC1
|
|
| MCULE-2290595555 |
0.78 |
CCN1CCN(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)CC1
|
|
| MCULE-6114626059 |
0.78 |
CC(CN1CCN(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)CC1)C
|
|
| MCULE-8685198387 |
0.78 |
CN1CCN(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)CC1
|
|
| MCULE-4444624653 |
0.78 |
OC(C1C(C(NC(C(N2CCCC2)=O)CC2C=CC=CC=2)=O)C1)=O
|
|
| MCULE-3160964482 |
0.78 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(COC)=O
|
|
| MCULE-3626610940 |
0.78 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(C(COC)=O)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-1303961251 |
0.78 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(C(=O)C(C)(C)OC)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-6692299946 |
0.78 |
N1(CCCC(C2C=CC=CC=2)(C2C=CC=CC=2)C1)C(=O)[C@H]1C[C@@H](CN1)O
|
|
| MCULE-3293603480 |
0.78 |
CC(N1[C@@H](C(N2CCC(CCC3=CC=C(C)C=C3)CC2)=O)C[C@H](O)C1)=O
|
|
| MCULE-5277558634 |
0.78 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2C=CC=CC=2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(CCC1=CC=C(C=C1)F)=O
|
|
| MCULE-7095137623 |
0.78 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(=O)C(C)(C)OC
|
|
| MCULE-5325539589 |
0.78 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(CC1C=CC(=CC=1)C1C=CC=CC=1)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-3196754485 |
0.78 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC(COC)=O
|
|
| MCULE-2979640385 |
0.78 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC(=O)C(C)(C)OC
|
|
| MCULE-9906168190 |
0.78 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(COC)=O
|
|
| MCULE-9069718059 |
0.78 |
O=C(NCC(NC(CC1C=CC=CC=1)C(O)=O)=O)C(N)CC(C)C
|
|
| MCULE-1918011369 |
0.78 |
N1(CCC(O)(C2C=CC=CC=2)C1)C(=O)C(C)(C)N1CCCC1
|
|
| MCULE-9693152448 |
0.78 |
CCN(C(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)CCO
|
|
| MCULE-5794030705 |
0.78 |
CCC(CN(C(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)C)C
|
|
| MCULE-9739430579 |
0.78 |
CC1C(C)C(C)N(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)C1
|
|
| MCULE-5526189740 |
0.78 |
CC1C(C)N(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)CC1
|
|
| MCULE-8590982688 |
0.78 |
CCC(CNC(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)(CC)O
|
|
| MCULE-5203956589 |
0.78 |
CC(CC(NC(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)C)C
|
|
| MCULE-7036666132 |
0.78 |
CC1(C(O)CN(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)C1)C
|
|
| MCULE-6893326009 |
0.78 |
CCC(NC(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)CC
|
|
| MCULE-9212061064 |
0.78 |
CC(N(C(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)C)C
|
|
| MCULE-6937755337 |
0.78 |
COC1=CC=C(C2CN(C(C3(N(C)CC(O)C3)C)=O)CC2)C=C1
|
|
| MCULE-4823093699 |
0.78 |
CC(C(CNC(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)(C)C)C
|
|
| MCULE-3421253884 |
0.78 |
CCN(C(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)CC
|
|
| MCULE-2445419349 |
0.78 |
C[C@H](CNC(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)O
|
|
| MCULE-4678340072 |
0.78 |
CC(NC(C1NCC(O)C1)=O)CC1=CC=C(Br)C=C1
|
|
| MCULE-2096728858 |
0.78 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)NCCN(C(COC)=O)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-2731862731 |
0.78 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)NCCN(C(=O)C(C)(C)OC)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-7613726749 |
0.78 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2C=CC=CC=2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(=O)CN1CCCN(C)CC1
|
|
| MCULE-2560981068 |
0.78 |
C1C=C(C=CC=1)CC(O)C(=O)N(C)C(C(C)C)C(N1CCCC1C(=O)O)=O
|
|
| MCULE-8268498352 |
0.78 |
CC(NC(C(NC(C(=O)O)CC1C=CC=CC=1)=O)C1CCCC1)=O
|
|
| MCULE-9467708311 |
0.78 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(CC1=CC=NC=C1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-3782766240 |
0.78 |
OCC(NC(C1N(C2CC2)CCC1)=O)CC1=CC=CC=C1
|
|
| MCULE-8352995249 |
0.78 |
CO[C@@H]1CN(C(CCC2=CC=C(C(C)(C)C)C=C2)=O)[C@H](C(N)=O)C1
|
|
| MCULE-8748376517 |
0.78 |
N1(C[C@@H](C[C@H]1C(NCCOC)=O)O)C1CCN(CC1)C(CCC1=CC=CC=C1)=O
|
|
| MCULE-8093868778 |
0.78 |
CCC1=CC=C(CCC(N2[C@H](C(N)=O)C[C@H](OC)C2)=O)C=C1
|
|
| MCULE-5443184017 |
0.78 |
N1(C(=O)C(C)(C)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)C(C)(C)NC(=O)[C@H](C(C)C)NC(=O)C(C)(C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(C)NC([C@@H](NC(=O)C(C)(C)NC(=O)[C@@H]2CCCN2C(=O)C(C)(C)NC(=O)C)C)=O)CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(N[C@@H](CCC(=O)O)C(=O)N[C@@H](CCC(=O)N)C(N[C@@H](CC1C=CC=CC=1)CO)=O)=O
|
|
| MCULE-7360953028 |
0.78 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](C1=CC=CC=C1)C2=O)O
|
|
| MCULE-2030548641 |
0.78 |
OC(C(NC(CN1C(=O)CCCCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-4481390778 |
0.78 |
N1(C[C@@H](C[C@H]1C(N)=O)O)C1CCN(CC1)C(CCC1=CC=CC=C1)=O
|
|
| MCULE-2217106727 |
0.78 |
CN1C(C(NCC(C2=CC(C)=CC(C)=C2)O)=O)(C)CC(O)C1
|
|
| MCULE-2549975331 |
0.78 |
CN1C(C(NCC(C2=CC(C)=CC=C2)O)=O)(C)CC(O)C1
|
|
| MCULE-8019280157 |
0.78 |
N12C[C@@H](C[C@H]1C(=O)N[C@H](C1C=CC=CC=1)C2=O)O
|
|
| MCULE-6246582155 |
0.78 |
CN(C(CN1C(=O)CCCCC1)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-1519883840 |
0.78 |
CC(C(NC(C(=O)O)CC1C=CC=CC=1)=O)NC(C1CCCC1)=O
|
|
| MCULE-7701232240 |
0.78 |
CN(C(CN1C(=O)CCCCCC1)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-2423481943 |
0.78 |
C(=O)([C@H](CC1=CC=CC=C1)N(C)C)NC1(CCCC1)C(O)=O
|
|
| MCULE-4084723884 |
0.78 |
OC(C(NC(CN1C(=O)CCCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-9554597498 |
0.78 |
N12C[C@@H](C[C@@H]1C(=O)N[C@@H](C1=CC=CC=C1)C2=O)O
|
|
| MCULE-9093497651 |
0.78 |
CC(C(N(C(C(=O)O)CC1C=CC=CC=1)C)=O)NC(C1CCCC1)=O
|
|
| MCULE-2713156155 |
0.78 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(=O)CN1CCOCC1
|
|
| MCULE-8990701794 |
0.78 |
C(=O)(N[C@@H](CC1=CC=CC=C1)C(O)=O)C1(C2=CC=CC=C2)CCN(CC1)C(=O)[C@@H]1CCCN1
|
|
| MCULE-6703190453 |
0.78 |
CC1=CC=C(CCC(NCC(N2C(CC3=CC=CC=C3)(CO)CCC2)=O)=O)C=C1
|
|
| MCULE-2566637922 |
0.78 |
CC(C(C1=CC=C(F)C=C1)O)NC(C1(N(C)CC(O)C1)C)=O
|
|
| MCULE-6569464660 |
0.78 |
N1(CCNC(=O)C1CC1C=CC=CC=1)C(=O)CC1CCN(CC1)C(C)C
|
|
| MCULE-6929356132 |
0.78 |
CC1C=CC(CCC(NCC(N2[C@@H](C(=O)O)CCC2)=O)=O)=CC=1
|
|
| MCULE-2194016595 |
0.78 |
N1(CCCC2C=CC=CC=2)CC2(CC1=O)CCN(CC2)C(=O)[C@@H]1C[C@H](CN1)O
|
|
| MCULE-8710696985 |
0.78 |
CC1C=CC(CCC(NCC(N2C(C(=O)O)CCC2)=O)=O)=CC=1
|
|
| MCULE-2639273198 |
0.78 |
CC1C=CC(CCC(NCC(N2C(C(=O)O)(C)CCC2)=O)=O)=CC=1
|
|
| MCULE-4226420427 |
0.78 |
N1(CCCC2C=CC=CC=2)CC2(CC1=O)CCN(CC2)C(=O)[C@H]1C[C@@H](CN1)O
|
|
| MCULE-2510023080 |
0.78 |
CC1C=CC(CCC(NCC(N2[C@H](C(=O)O)CCC2)=O)=O)=CC=1
|
|
| MolPort-012-040-543 |
0.78 |
CC(CC1=CC=C(Br)C=C1)NC(=O)C1CC(O)CN1
|
|
| MolPort-045-932-254 |
0.78 |
CC[C@H](C)[C@@H]1NC(=O)CN(CC2=CC=NC=C2)CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O
|
|
| MolPort-038-386-554 |
0.78 |
CC(C)C(N(C)C(=O)C(O)CC1=CC=CC=C1)C(=O)N1CCCC1C(O)=O
|
|
| MolPort-045-918-637 |
0.78 |
COC(C)(C)C(=O)N1CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](C)N(C)C(=O)[C@H](CC(C)C)NC(=O)C1
|
|
| MolPort-045-915-139 |
0.78 |
COCC(=O)N1CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](C)N(C)C(=O)[C@H](CC(C)C)NC(=O)C1
|
|
| MolPort-044-352-001 |
0.78 |
COCCNC(=O)[C@@H]1C[C@@H](O)CN1C1CCN(CC1)C(=O)CCC1=CC=CC=C1
|
|
| MolPort-003-925-459 |
0.78 |
CC(C)C[C@H](NC(=O)CNC(=O)C(C)(C)NC(=O)[C@@H](NC(=O)C(C)(C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](C)NC(=O)C(C)(C)NC(=O)[C@H](C)NC(=O)C(C)(C)NC(=O)[C@@H]1CCCN1C(=O)C(C)(C)NC(C)=O)C(C)C)C(=O)NC(C)(C)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)NC(C)(C)C(=O)NC(C)(C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@H](CO)CC1=CC=CC=C1
|
|
| MolPort-039-167-240 |
0.78 |
CO[C@H]1C[C@H](N(C1)C(=O)CCC1=CC=C(C=C1)C(C)(C)C)C(N)=O
|
|
| MolPort-039-166-888 |
0.78 |
CCC1=CC=C(CCC(=O)N2C[C@H](C[C@H]2C(N)=O)OC)C=C1
|
|
| MolPort-044-367-838 |
0.78 |
NC(=O)[C@@H]1C[C@@H](O)CN1C1CCN(CC1)C(=O)CCC1=CC=CC=C1
|
|
| MolPort-045-912-326 |
0.78 |
O[C@@H]1C[C@H]2N(C1)C(=O)[C@@H](NC2=O)C1=CC=CC=C1
|
|
| MolPort-039-110-877 |
0.78 |
CN(C)[C@@H](CC1=CC=CC=C1)C(=O)NC1(CCCC1)C(O)=O
|
|
| MolPort-045-956-403 |
0.78 |
O[C@@H]1C[C@@H]2N(C1)C(=O)[C@H](NC2=O)C1=CC=CC=C1
|
|
| MolPort-045-954-839 |
0.78 |
O[C@@H]1C[C@@H]2N(C1)C(=O)[C@@H](NC2=O)C1=CC=CC=C1
|
|
| MolPort-002-533-097 |
0.78 |
OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C1(CCN(CC1)C(=O)[C@@H]1CCCN1)C1=CC=CC=C1
|
|
| MolPort-035-753-703 |
0.78 |
CC1=CC=C(CCC(=O)NCC(=O)N2CCCC2(CO)CC2=CC=CC=C2)C=C1
|
|
| MolPort-016-609-888 |
0.78 |
CC(C)N1CCC(CC(=O)N2CCNC(=O)C2CC2=CC=CC=C2)CC1
|
|
| MolPort-046-702-135 |
0.78 |
CCC(C)CC(=O)NC(C(C)CC)C(=O)NC(C)C(=O)NCC(=O)NC(CCCCN)C(=O)NC(CC(N)=O)C(=O)NC(CO)C(=O)NCC(=O)NC(C(C)C)C(=O)NC(CC(O)=O)C(=O)NC(CCC(O)=O)C(=O)NC(C)C(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC1=CC=CC=C1)C(=O)NC(C(C)C)C(=O)NC(CC(C)C)C(=O)NC(CCCCN)C(=O)NC(CCC(N)=O)C(=O)NC
|
|
| MolPort-028-588-791 |
0.78 |
O[C@H]1CN[C@@H](C1)C(=O)N1CCC2(CN(CCCC3=CC=CC=C3)C(=O)C2)CC1
|
|
| MolPort-027-884-301 |
0.78 |
O[C@@H]1CN[C@H](C1)C(=O)N1CCC2(CN(CCCC3=CC=CC=C3)C(=O)C2)CC1
|
|
| MolPort-045-935-435 |
0.77 |
CC(C)C[C@@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)CNC(=O)N(C)C
|
|
| MolPort-001-748-387 |
0.77 |
CN[C@@H](C(C)C)C(=O)N[C@H]1C[C@](O)(C[C@@H](O)[C@@H]1O)C(=O)N[C@H](CC1=CC=CC=C1)C(N)=O
|
|
| MolPort-046-567-883 |
0.77 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CCSC
|
|
| MolPort-046-418-700 |
0.77 |
CC(C)[C@H](NC(=O)[C@H](CO)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H]1CCCN1C(C)=O)C(=O)N[C@@H](CCC(N)=O)C(N)=O
|
|
| MolPort-006-133-137 |
0.77 |
CC(C)C[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(O)=O
|
|
| MolPort-039-159-771 |
0.77 |
CO[C@H]1C[C@H](N(C)C1)C(=O)NCC1(CC1)C1=CC=CC=C1
|
|
| MolPort-023-276-930 |
0.77 |
CC(C)C[C@@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(O)=O
|
|
| MolPort-021-675-994 |
0.77 |
CC(C)CC1NC(=O)C(CC2=CC=CC=C2)NC1=O
|
|
| MolPort-019-939-055 |
0.77 |
CC(C)C[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)[C@H](N)CC1=CC=C(O)C=C1)C(O)=O
|
|
| MolPort-003-937-802 |
0.77 |
CC(C)C[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(O)=O
|
|
| MolPort-044-596-402 |
0.77 |
OC1CCCCN(CC(=O)N2CC(CC3=CC=CC=C3)(C2)C2=CC=CC=C2)C1=O
|
|
| MolPort-003-981-151 |
0.77 |
CC(C)CC(NC(=O)C(CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)C(N)CC1=CC=C(O)C=C1)C(O)=O
|
|
| MolPort-002-510-559 |
0.77 |
CC(C)C[C@@H]1NC(=O)[C@H](CC2=CC=CC=C2)NC1=O
|
|
| MolPort-046-418-722 |
0.77 |
C[C@@H](O)[C@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)CN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(O)=O)C(=O)NCC(O)=O
|
|
| MolPort-039-235-305 |
0.77 |
OC1CNC(C1)C(=O)NCC(C1=CC=CC=C1)C1=CC=CC=C1
|
|
| MolPort-046-683-511 |
0.77 |
CCCC[C@H](NC=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCC)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N[C@@H](CCCCN)C(O)=O
|
|
| MolPort-045-932-484 |
0.77 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)CCC1=CN(C)N=C1
|
|
| MolPort-035-371-783 |
0.77 |
CC1=C(CC2(CC2)NC(=O)[C@H]2C[C@@H](O)CN2)C=CC=C1
|
|
| MolPort-045-938-597 |
0.77 |
CN1CCC[C@H]1C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(O)=O
|
|
| MolPort-012-238-213 |
0.77 |
OC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@@H]1CCCN1
|
|
| MolPort-002-510-208 |
0.77 |
OC(=O)C[C@@H]1NC(=O)[C@H](CC2=CC=CC=C2)NC1=O
|
|
| MolPort-002-929-930 |
0.77 |
OC(=O)CC1NC(=O)C(CC2=CC=CC=C2)NC1=O
|
|
| MolPort-016-594-373 |
0.77 |
COCC1(CCC1)C(=O)N1CCNC(=O)[C@@H]1CC1=CC=CC=C1
|
|
| MolPort-044-561-875 |
0.77 |
C[C@@H](O)C(=O)CCCCC[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](CC2=CC=CC=C2)NC(=O)C(C)(C)NC1=O
|
|
| MolPort-039-293-805 |
0.77 |
CC(CC1=CC=C(C=C1)C(F)(F)F)NC(=O)C1CC(O)CN1
|
|
| MolPort-044-596-379 |
0.77 |
CN1CCN(CC1CC1=CC=CC=C1)C(=O)CN1CCCCC(O)C1=O
|
|
| MolPort-046-570-076 |
0.77 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)[C@H]1CCCO1
|
|
| MolPort-046-567-636 |
0.77 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)[C@@H]1CCCO1
|
|
| MolPort-042-410-716 |
0.77 |
OC(=O)[C@@H]1CN(C[C@@H]1C1=CC=CC=C1)C(=O)CN1CCCCCC1=O
|
|
| MolPort-042-410-342 |
0.77 |
OC(=O)[C@@H]1CN(C[C@@H]1C1=CC=CC=C1)C(=O)CN1CCCCCCC1=O
|
|
| MolPort-000-778-830 |
0.77 |
CC(C)C[C@H]1NC(=O)[C@@H](CCCN)NC(=O)[C@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCCN)NC(=O)[C@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)C(C)C)C(C)C
|
|
| MolPort-046-577-416 |
0.77 |
CC[C@H]1CN(CC(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N1)C(=O)[C@@H]1CCC(=O)N1
|
|
| MolPort-046-576-733 |
0.77 |
CC[C@H]1CN(CC(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N1)C(=O)[C@H]1CCC(=O)N1
|
|
| MCULE-2433074064 |
0.77 |
N12CCCC1C(=O)NC(C(C)C)C(=O)NC(CCCN)C(=O)NC(CC(C)C)C(=O)NC(CC1C=CC=CC=1)C(=O)N1C(CCC1)C(=O)NC(C(C)C)C(=O)NC(CCCN)C(=O)NC(CC(C)C)C(=O)NC(CC1C=CC=CC=1)C2=O |
|
| MolPort-046-567-986 |
0.77 |
COCC(=O)N1C[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC(=O)[C@@H](C)NC(=O)[C@H](C)N(C)C(=O)[C@H](CC(C)C)NC(=O)C1)C(C)C
|
|
| MolPort-023-276-705 |
0.77 |
NCCCC[C@H](N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-002-529-802 |
0.77 |
OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C1CCN(CC1)C(=O)[C@@H]1CCCN1
|
|
| MolPort-019-939-209 |
0.77 |
NCCCC[C@@H](N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)N1CCC[C@@H]1C(=O)NCC(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@H](CO)C(=O)N1CCC[C@@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MCULE-9561702045 |
0.77 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(CNC(=O)N(C)C)=O
|
|
| MCULE-5680940501 |
0.77 |
O[C@@H]1C[C@](C(=O)N[C@H](CC2C=CC=CC=2)C(N)=O)(C[C@@H]([C@H]1O)NC([C@H](C(C)C)NC)=O)O
|
|
| MCULE-9327446936 |
0.77 |
C([C@@H]1CCCN1C(=O)C)(=O)N[C@H](C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CO)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](C(=O)N)CCC(=O)N)CC1C=CC=CC=1
|
|
| MCULE-9817856648 |
0.77 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)CCSC)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-6266593389 |
0.77 |
N12C[C@@H](CC1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)=O)N
|
|
| MCULE-5805509131 |
0.77 |
[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC1C=CC(O)=CC=1)(C(=O)N[C@H](C(=O)O)CC(C)C)CC1C=CC=CC=1
|
|
| MCULE-6254218030 |
0.77 |
CO[C@@H]1CN(C)[C@H](C(NCC2(C3=CC=CC=C3)CC2)=O)C1
|
|
| MCULE-5427803093 |
0.77 |
[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC1C=CC(O)=CC=1)(C(=O)N[C@H](C(=O)O)CC(C)C)CC1C=CC=CC=1
|
|
| MCULE-8309387994 |
0.77 |
C(O)(=O)[C@H](CC(C)C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)[C@@H](C)NC(=O)[C@H](CC1C=CC(O)=CC=1)N
|
|
| MCULE-8979728112 |
0.77 |
O=C([C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](NC(=O)[C@H](CC1C=CC(O)=CC=1)N)C)CC1C=CC=CC=1)CC(C)C)O
|
|
| MCULE-1655109072 |
0.77 |
C(C1C=CC(O)=CC=1)[C@@H](N)C(NCC(NCC(N[C@@H](C(N[C@H](CC(C)C)C(O)=O)=O)CC1C=CC=CC=1)=O)=O)=O
|
|
| MCULE-8145218483 |
0.77 |
OC1C(=O)N(CC(N2CC(C3=CC=CC=C3)(CC3=CC=CC=C3)C2)=O)CCCC1
|
|
| MCULE-7896999191 |
0.77 |
C1(CC2C=CC=CC=2)C(=O)NC(CC(C)C)C(=O)N1
|
|
| MCULE-6970328466 |
0.77 |
CC(C(NC(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)CCO)C
|
|
| MCULE-5779590560 |
0.77 |
CN(CCN(C(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)C)C
|
|
| MCULE-6209921848 |
0.77 |
CC(C1CC1)(CNC(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)O
|
|
| MCULE-4251499204 |
0.77 |
CCC1(CCN(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)CC1)CO
|
|
| MCULE-8132101932 |
0.77 |
C[C@H](NC(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)CN(C)C
|
|
| MCULE-5717657606 |
0.77 |
C(O)(=O)[C@H](CCCCN)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CCCC)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCC)NC=O
|
|
| MCULE-7010478157 |
0.77 |
CC([C@H]1[C@H](NC(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)C1)C
|
|
| MCULE-9837497738 |
0.77 |
OC1CC(C(NCC(C2=CC=CC=C2)C2=CC=CC=C2)=O)NC1
|
|
| MCULE-5829208290 |
0.77 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(CCC1C=NN(C)C=1)=O)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-1072106569 |
0.77 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(CC(=O)N[C@@H]([C@@H](C)CC)C2=O)C(=O)C1=C(C=CC=C1F)F)O
|
|
| MCULE-3037591941 |
0.77 |
[C@@H]1(NCCC1)C(=O)N[C@H](C(=O)O)CC1=CC=C(O)C=C1
|
|
| MCULE-4623395510 |
0.77 |
C(O)(=O)C[C@H]1C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N1
|
|
| MCULE-6862616446 |
0.77 |
CC(NC(C1(N(C)CC(O)C1)C)=O)CC1=CC(O)=CC=C1
|
|
| MCULE-4177491447 |
0.77 |
CN1C(CC2=CC=CC=C2)CN(C(CN2C(=O)C(O)CCCC2)=O)CC1
|
|
| MCULE-5207909372 |
0.77 |
C1(CC2C=CC=CC=2C)(CC1)NC(=O)[C@H]1C[C@H](CN1)O
|
|
| MCULE-4739491162 |
0.77 |
N1C(CC(O)=O)C(=O)NC(CC2=CC=CC=C2)C1=O
|
|
| MCULE-4899243040 |
0.77 |
CC(NC(C1NCC(O)C1)=O)CC1C=CC(C(F)(F)F)=CC=1
|
|
| MCULE-2769008276 |
0.77 |
N1(CCNC(=O)[C@@H]1CC1=CC=CC=C1)C(=O)C1(CCC1)COC
|
|
| MCULE-8644054163 |
0.77 |
C(=O)([C@@H]1CCCN1C)N[C@@H](CC1=CC=C(C=C1)O)C(O)=O
|
|
| MCULE-6464033450 |
0.77 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)[C@@H]1CCCO1)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-5962886735 |
0.77 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)[C@H]1CCCO1)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-3304087665 |
0.77 |
OC([C@H]1[C@@H](C2=CC=CC=C2)CN(C(CN2C(=O)CCCCC2)=O)C1)=O
|
|
| MCULE-8146399627 |
0.77 |
OC([C@H]1[C@@H](C2=CC=CC=C2)CN(C(CN2C(=O)CCCCCC2)=O)C1)=O
|
|
| MCULE-8173469826 |
0.77 |
CC(C(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)NC(C1CCCC1)=O
|
|
| MCULE-9231905567 |
0.77 |
CCCC(N1C(C(N2C[C@@H](C3C=CC=CC=3)[C@@H](C(=O)O)C2)=O)CCCC1)=O
|
|
| MCULE-8289184124 |
0.77 |
OC([C@H]1[C@@H](C2C=CC=CC=2)CN(C(CN2C(=O)CCCCCC2)=O)C1)=O
|
|
| MCULE-9733446541 |
0.77 |
OC([C@H]1[C@@H](C2C=CC=CC=2)CN(C(CN2C(=O)CCCCC2)=O)C1)=O
|
|
| MCULE-1060977273 |
0.77 |
CC(CN1C(C(NC(CC2=CC(C)=CC=C2)CO)=O)CCC1)C
|
|
| MCULE-1645104121 |
0.77 |
CC(N(CC(N1[C@H](C(=O)O)CCC1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-6058640105 |
0.77 |
N12CCC[C@]1([H])C(=O)N[C@]([H])(C(C)C)C(=O)N[C@]([H])(CCCN)C(=O)N[C@]([H])(CC(C)C)C(=O)N[C@@]([H])(CC1=CC=CC=C1)C(=O)N1[C@]([H])(CCC1)C(=O)N[C@]([H])(C(C)C)C(=O)N[C@]([H])(CCCN)C(=O)N[C@]([H])(CC(C)C)C(=O)N[C@@]([H])(CC1C=CC=CC=1)C2=O
|
|
| MCULE-3053623573 |
0.77 |
CC(N(CC(N1[C@@H](C(=O)O)CCC1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-8887937687 |
0.77 |
N1(C[C@H](CC)NC(=O)[C@H](CC2=CC=CC=C2)NC([C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C1)=O)C(=O)[C@H]1CCC(=O)N1
|
|
| MCULE-3518431828 |
0.77 |
CC(N(CC(N1C(C(=O)O)(C)CCC1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-4271576613 |
0.77 |
CN1[C@@H](C(NC(CC2=CC(C)=CC=C2)CO)=O)CCC1
|
|
| MCULE-3697351873 |
0.77 |
CC(N(CC(N1C(C(=O)O)CCC1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-1296089889 |
0.77 |
N1(C[C@H](CC)NC(=O)[C@H](CC2=CC=CC=C2)NC([C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C1)=O)C(=O)[C@@H]1CCC(=O)N1
|
|
| MCULE-3189844002 |
0.77 |
N1(C)[C@@H](C)C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC2C=CC=CC=2)CN(C(COC)=O)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-9152473542 |
0.77 |
C(=O)([C@@H]1CCCN1)N1CCC(CC1)C(=O)N[C@@H](CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-8537702567 |
0.77 |
C(CCCN)[C@H](C(N[C@@H](CCCNC(N)=N)C(N1[C@H](CCC1)C(N1[C@H](CCC1)C(NCC(N[C@@H](C(N[C@H](CO)C(N1[C@H](CCC1)C(N[C@H](C(O)=O)CC1C=CC=CC=1)=O)=O)=O)CC1C=CC=CC=1)=O)=O)=O)=O)=O)N
|
|
| MCULE-5687802486 |
0.77 |
Cl.C(=O)(N[C@@H](CC1=CC=CC=C1)C(O)=O)C1(C2=CC=CC=C2)CCN(CC1)C(=O)[C@@H]1CCCN1
|
|
| MCULE-4219422173 |
0.77 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(=O)C1(CCC1)COC)C
|
|
| MCULE-6416559713 |
0.77 |
N12CC3C=CC=CC=3C[C@@H]1C(=O)N1[C@@H](C[C@H](C1)O)C2=O
|
|
| MCULE-7117124003 |
0.77 |
C(C1C=CC=CC=1)[C@H]1NC([C@@H](NC([C@]([H])(CCNC([C@]([H])([C@H](O)C)NC(=O)[C@H](CCN)NC(=O)[C@]([H])(CCN)NC(=O)[C@H](CC(C)C)NC1=O)=O)NC(=O)[C@H](CCN)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCN)NC(=O)CCCC[C@@H](C)CC)=O)CCN)=O
|
|
| MCULE-1355686634 |
0.77 |
C(C1C=CC=CC=1)[C@H]1NC([C@@H](NC([C@]([H])(CCNC([C@]([H])([C@H](O)C)NC(=O)[C@H](CCN)NC(=O)[C@]([H])(CCN)NC(=O)[C@H](CC(C)C)NC1=O)=O)NC(=O)[C@H](CCN)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCN)NC(=O)CCCCC(C)C)=O)CCN)=O
|
|
| MCULE-9495858892 |
0.77 |
CCC(CCCCC(NC(C(NC(C(NC(C(NC1C(=O)NC(CCN)C(=O)NC(CC2C=CC=CC=2)C(=O)NC(CC(C)C)C(=O)NC(CCN)C(=O)NC(CCN)C(=O)NC(C(O)C)C(=O)NCC1)=O)CCN)=O)C(O)C)=O)CCN)=O)C
|
|
| MCULE-5984999745 |
0.77 |
CCC1=CC=C(CCC(N2[C@@H](CO)CN3[C@@H](CCC3)C2)=O)C=C1
|
|
| MCULE-2427835898 |
0.77 |
CC(CC(NC(C(NC(C(=O)O)CC1C=CC=CC=1)=O)C(C)C)=O)C
|
|
| MCULE-4986086345 |
0.77 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)NCCN(C(=O)CC2CCN(CC2)C(C)C)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-8645348696 |
0.77 |
CC(C(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)NC(CC(C)(C)C)=O
|
|
| MCULE-5922163904 |
0.77 |
C(C1C=CC=CC=1)C(C(O)=O)NC(=O)C(N)CC(C)C
|
|
| MCULE-9146185880 |
0.77 |
CC1=CC=C(CCC(N2[C@@H](CO)CN3[C@@H](CCC3)C2)=O)C=C1
|
|
| MCULE-1671951726 |
0.77 |
C(O)(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(C)C)N
|
|
| MCULE-6190223523 |
0.77 |
N12C[C@@H](CC1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)=O)NC(=O)CN1CCCC1
|
|
| MCULE-1968620616 |
0.77 |
CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC1C=CC(O)=CC=1)C(C)C)CC(=O)O)CCCCN
|
|
| MCULE-9662794145 |
0.77 |
CC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC1C=CC(O)=CC=1)C(C)C)CC(=O)O)CCCCN
|
|
| MCULE-6148206244 |
0.77 |
N12C[C@@H](CC1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)=O)NC(CCCC)=O
|
|
| MCULE-9932982047 |
0.77 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)C1(CCC1)C1=CC=C(C=C1)Cl)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
|
|
| MCULE-1716319206 |
0.77 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(=O)[C@@H]1CCCN2CCCC[C@]12[H]
|
|
| MCULE-9014478888 |
0.77 |
C(=O)([C@@H]1C[C@H](CN1)O)N1CCC(CC1)(C1C=CC=CC=1)C(C)=O
|
|
| MCULE-4892063356 |
0.77 |
N1(CCC(O)(C2C=CC=CC=2)C1)C(=O)CN1CCCCCC1
|
|
| MCULE-6751194955 |
0.77 |
C1(CC2C(=O)N3CCCC3C(=O)N2)=CC=C(O)C=C1
|
|
| MCULE-6517589978 |
0.77 |
O=C1N[C@](C(N2[C@]1(CCC2)[H])=O)(CC1=CC=C(O)C=C1)[H]
|
|
| MCULE-2884113138 |
0.77 |
C(=O)(N[C@@H](CC1C=CC=CC=1)C(O)=O)C1(CCCC1)N1CCCC1
|
|
| MCULE-7763212551 |
0.77 |
OC[C@@H]1N(C(C2C3=C(C=CC=C3)C2)=O)C[C@H]2N(CCC2)C1
|
|
| MCULE-1965329309 |
0.77 |
OC1CC(C(NCC2(C3C=CC(Br)=CC=3)CCC2)=O)NC1
|
|
| MCULE-6534662802 |
0.77 |
CC(=O)NC(CC1C=CC=CC=1)C(=O)NC(CC(C)C)C(OC)=O
|
|
| MCULE-4144434406 |
0.77 |
OC1CC(C(NCC2(C3=CC=CC=C3)CCOCC2)=O)NC1
|
|
| MCULE-8136260514 |
0.77 |
N12CCC[C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CN(C(C1CCOCC1)=O)CC(=O)N[C@@H](C)C2=O)CC1C=CC=CC=1
|
|
| MCULE-1799287926 |
0.77 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(=O)C1CCN(CC1)CCOC)C
|
|
| MCULE-6370457092 |
0.77 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)COC1C=CC(=C(C)C=1)C)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-8618570361 |
0.77 |
N12C[C@@H](C[C@H]1C(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)COC1=CC=C(C=C1)C[C@H](NC(CCC1C=CC(=CC=1)OC)=O)C(=O)N[C@@H](CC)C2=O)O
|
|
| MCULE-1166555628 |
0.77 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(C1=CC=NC=C1)=O)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-2463463875 |
0.77 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(NCCN2CCC(O)CC2)=O)C1
|
|
| MCULE-3124770105 |
0.77 |
N1(CCC(O)(C2C=CC=CC=2C)C1)C(=O)CN1CCCCCC1=O
|
|
| MCULE-3441711823 |
0.77 |
N12CCC[C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CN(C(=O)CNC(C)=O)CC(=O)N[C@@H](C)C2=O)CC1=CC=CC=C1
|
|
| MCULE-8489780773 |
0.77 |
N12CCC[C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CN(C(=O)CN(C)C)CC(=O)N[C@@H](C)C2=O)CC1C=CC=CC=1
|
|
| MCULE-4146942945 |
0.77 |
CCC[C@@H](C(N1CC(CC2=CC=CC=C2)NCC1)=O)O
|
|
| MCULE-7207819392 |
0.77 |
N12CCC[C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CNCC(=O)N[C@@H](C)C2=O)CC1C=CC=CC=1
|
|
| MCULE-4686576101 |
0.77 |
CCCC(C(NC(C(N1CCCC1)=O)CC1C=CC=CC=1)=O)N
|
|
| MCULE-8396371270 |
0.77 |
N12CCC[C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CN(C(CCC(C)C)=O)CC(=O)N[C@@H](C)C2=O)CC1=CC=CC=C1
|
|
| MCULE-1772260642 |
0.77 |
N12CCC[C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CN(C(=O)C(C)(C)C)CC(=O)N[C@@H](C)C2=O)CC1C=CC=CC=1
|
|
| MCULE-8734770326 |
0.77 |
N12CCC[C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CN(C(C(C)C)=O)CC(=O)N[C@@H](C)C2=O)CC1=CC=CC=C1
|
|
| MCULE-9217542227 |
0.77 |
C(O)(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CO)N
|
|
| MCULE-9708423897 |
0.77 |
C(C1C=CC=CC=1)[C@H](N)C(NCC(NCC(N[C@@H](C(N[C@@H]([C@H](O)C)C(NCC(N[C@H](C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CCCCN)C(N[C@H](CO)C(N[C@H](C(N[C@@H](CCCNC(N)=N)C(N[C@H](CCCCN)C(N)=O)=O)=O)C)=O)=O)=O)=O)C)=O)=O)=O)CC1C=CC=CC=1)=O)=O)=O
|
|
| MCULE-8844450361 |
0.77 |
CC(C[C@H](C(=O)O)NC(C1N(C(CC2C=CC=CC=2)=O)CCC1)=O)C
|
|
| MCULE-9786315376 |
0.77 |
N1(C)[C@@H](C)C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC2=CC=CC=C2)CN(C(=O)CCOC)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-8417438138 |
0.77 |
CCCC(C(O)=O)NC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O
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|
| MCULE-1754374732 |
0.77 |
N1(C[C@@H](C[C@H]1C(NC)=O)O)C1CCN(CC1)CCCC1C=CC=CC=1
|
|
| MolPort-046-568-724 |
0.77 |
COCC1(CCC1)C(=O)N[C@H]1CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC(=O)[C@H](NC1=O)C(C)C
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|
| MolPort-000-790-805 |
0.77 |
Cl.OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C1(CCN(CC1)C(=O)[C@@H]1CCCN1)C1=CC=CC=C1
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|
| MolPort-045-934-370 |
0.77 |
CC(C)C[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](C)N(C)C1=O)C(=O)CC1CCN(CC1)C(C)C
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| MolPort-044-561-193 |
0.77 |
CCC(C)CCCCC(=O)N[C@@H](CCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCN)C(=O)N[C@H]1CCNC(=O)[C@@H](NC(=O)[C@H](CCN)NC(=O)[C@H](CCN)NC(=O)[C@@H](NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCN)NC1=O)[C@@H](C)CC)[C@@H](C)O
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| MolPort-045-912-012 |
0.77 |
O[C@@H]1C[C@@H]2N(C1)C(=O)[C@H]1CC3=C(CN1C2=O)C=CC=C3
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| MolPort-044-561-192 |
0.77 |
CC[C@H](C)CCCCC(=O)N[C@@H](CCN)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CCN)C(=O)N[C@H]1CCNC(=O)[C@@H](NC(=O)[C@H](CCN)NC(=O)[C@H](CCN)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCN)NC1=O)[C@@H](C)O
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| MolPort-003-957-069 |
0.77 |
CC(C)CC(N)C(=O)NC(CC1=CC=CC=C1)C(O)=O
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CC(C)C[C@H](NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H]([C@@H](C)O)C(N)=O
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|
| MolPort-039-284-667 |
0.77 |
CC1CCCN1CC(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
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| MolPort-012-238-315 |
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CC(C)C[C@H](N)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
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|
| MolPort-039-284-666 |
0.77 |
CC1CCCN1CC(=O)N[C@H](CC1=CC=CC=C1)C(O)=O
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| MolPort-030-084-299 |
0.77 |
NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCC(O)=O
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| MolPort-045-935-093 |
0.77 |
CC(C)C[C@@H]1NC(=O)[C@@H]2CCC[C@H]2NC(=O)[C@H](C)NC(=O)C2C[C@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CN1CCCC1
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| MolPort-045-932-873 |
0.77 |
CCCCC(=O)N[C@@H]1CC2N(C1)C(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCC[C@H]1NC(=O)[C@H](C)NC2=O)[C@@H](C)O
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| MolPort-045-918-578 |
0.77 |
CC(C)[C@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)[C@@H]1CCCN2CCCC[C@H]12
|
|
| MolPort-046-573-204 |
0.77 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)C1(CCC1)C1=CC=C(Cl)C=C1
|
|
| MolPort-044-649-457 |
0.77 |
CC(C)[C@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCN)NC(C)=O)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(O)=O
|
|
| MolPort-044-688-706 |
0.77 |
OC1(CCN(C1)C(=O)CN1CCCCCC1)C1=CC=CC=C1
|
|
| MolPort-001-740-017 |
0.77 |
OC1=CC=C(CC2NC(=O)C3CCCN3C2=O)C=C1
|
|
| MolPort-021-764-479 |
0.77 |
CC(=O)C1(CCN(CC1)C(=O)[C@@H]1C[C@@H](O)CN1)C1=CC=CC=C1
|
|
| MolPort-042-643-315 |
0.77 |
OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C1(CCCC1)N1CCCC1
|
|
| MolPort-039-235-306 |
0.77 |
OC1CNC(C1)C(=O)NCC1(CCOCC1)C1=CC=CC=C1
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|
| MolPort-039-293-808 |
0.77 |
OC1CNC(C1)C(=O)NCC1(CCC1)C1=CC=C(Br)C=C1
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|
| MolPort-046-569-841 |
0.77 |
CC(C)[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](C)NC(=O)CN(C[C@H](CC2=CC=CC=C2)NC1=O)C(=O)C1CCOCC1
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|
| MolPort-046-702-114 |
0.77 |
CCC(C)C(NC(=O)C(NC(=O)C(CC1=CC=CC=C1)NC(=O)C(NC(=O)C(NC(=O)C(CCCCN)NC(=O)C(CCC(O)=O)NC(=O)C(NC(=O)C1CCCN1C(=O)C(CCCN=C(N)N)NC(=O)C(N)CO)C(C)O)C(C)O)C(C)CC)C(C)CC)C(O)=O
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|
| MolPort-046-568-304 |
0.77 |
COCCN1CCC(CC1)C(=O)N[C@H]1CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC(=O)[C@H](NC1=O)C(C)C
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|
| MolPort-046-741-318 |
0.77 |
CC[C@@H]1NC(=O)[C@H](CC2=CC=C(OC[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H]3C[C@@H](O)CN3C1=O)C=C2)NC(=O)CCC1=CC=C(OC)C=C1
|
|
| MolPort-045-932-670 |
0.77 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)COC1=CC=C(C)C(C)=C1
|
|
| MolPort-046-585-666 |
0.77 |
CC1=C(C=CC=C1)C1(O)CCN(C1)C(=O)CN1CCCCCC1=O
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|
| MolPort-046-572-876 |
0.77 |
CC(C)[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](C)NC(=O)CN(C[C@H](CC2=CC=CC=C2)NC1=O)C(=O)CN(C)C
|
|
| MolPort-046-569-954 |
0.77 |
CC(C)[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](C)NC(=O)CN(C[C@H](CC2=CC=CC=C2)NC1=O)C(=O)CNC(C)=O
|
|
| MolPort-046-567-456 |
0.77 |
CC(C)[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](C)NC(=O)CN(C[C@H](CC2=CC=CC=C2)NC1=O)C(=O)C(C)(C)C
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|
| MolPort-046-568-285 |
0.77 |
CC(C)CCC(=O)N1C[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC(=O)[C@H]2CCCN2C(=O)[C@H](C)NC(=O)C1)C(C)C
|
|
| MolPort-046-573-807 |
0.77 |
CC(C)[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](C)NC(=O)CN(C[C@H](CC2=CC=CC=C2)NC1=O)C(=O)C(C)C
|
|
| MolPort-046-569-928 |
0.77 |
CC(C)[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](C)NC(=O)CNC[C@H](CC2=CC=CC=C2)NC1=O
|
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| MolPort-023-275-995 |
0.77 |
C[C@@H](O)[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)CNC[C@@H](N)CC1=CC=CC=C1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(N)=O
|
|
| MolPort-019-939-103 |
0.77 |
C[C@@H](O)[C@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](CCCCN)C(N)=O
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| MolPort-046-683-503 |
0.77 |
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](N)CO)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O
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| MolPort-046-568-709 |
0.77 |
COCCC(=O)N1C[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC(=O)[C@@H](C)NC(=O)[C@H](C)N(C)C(=O)[C@H](CC(C)C)NC(=O)C1)C(C)C
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| MolPort-044-367-793 |
0.77 |
CNC(=O)[C@@H]1C[C@@H](O)CN1C1CCN(CCCC2=CC=CC=C2)CC1
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| MolPort-044-534-966 |
0.76 |
CC(=O)NC(CC1=CC=C(O)C=C1)C(=O)N1CCC(O)CC(C)(C)C1
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| MolPort-039-293-793 |
0.76 |
CC(CC1=CC=CC=C1F)NC(=O)C1CC(O)CN1
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|
| MolPort-046-762-322 |
0.76 |
NCCCC[C@@H]1N([C@@H](CCC2=CC=CC=C2)C(O)=O)C(=O)C2CCCN2C1=O
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|
| MolPort-039-002-629 |
0.76 |
COC1(CC(=O)NC(CC2=CC=CC=C2)C(=O)N2CCCC2)CCC1
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| MolPort-045-932-606 |
0.76 |
COCC1(CCC1)C(=O)N1CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](C)N(C)C(=O)[C@H](CC(C)C)NC(=O)C1
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| MolPort-042-147-709 |
0.76 |
CC(C)NC(=O)N1CCC[C@H]1C(=O)NC(CC1=CC=CC=C1)C(O)=O
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| MolPort-020-134-439 |
0.76 |
CC(C)CCC(=O)NC(CC1=CC=CC=C1)C(=O)N1CCCC1
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| MolPort-023-276-079 |
0.76 |
C[C@@H](O)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(N)=N)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
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| MolPort-023-276-706 |
0.76 |
CC[C@H](C)[C@H](NC(=O)[C@@H](CC1=CC2=CC=CC=C2C=C1)NC(=O)[C@H](CO)NC(=O)[C@](C)(CC1=CC=CC=C1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCN)NC(C)=O)C(O)=O
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|
| MolPort-023-276-707 |
0.76 |
NCCCC[C@H](N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O
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| MolPort-023-276-795 |
0.76 |
CC[C@H](C)[C@H](NC(=O)[C@@H](CC1=CC2=CC=CC=C2C=C1)NC(=O)[C@H](CO)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCN)NC(C)=O)C(O)=O
|
|
| MolPort-039-238-380 |
0.76 |
C[C@H](NC(=O)C1CCCN1C(=O)CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-046-061-064 |
0.76 |
C[C@@H]1N([C@@H](CO)CN(C)C1=O)C(=O)CCCC1=CC=CC=C1
|
|
| MolPort-000-799-581 |
0.76 |
Cl.OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C1CCN(CC1)C(=O)[C@@H]1CCCN1
|
|
| MolPort-045-934-514 |
0.76 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)CCN1C=CC=N1
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| MolPort-046-765-045 |
0.76 |
[Na+].[Na+].CC(C)(C)CCN[C@@H](CC([O-])=O)C(=O)N[C@@H](CC1=CC=CC=C1)C([O-])=O
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| MolPort-046-441-002 |
0.76 |
CC1=CC=C(CCC(=O)NCC(=O)N2CCC(O)C22CCCC2)C=C1
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| MolPort-046-569-798 |
0.76 |
CC(C)[C@H]1NC(=O)[C@H](CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC1=O)NC(=O)C1CCOCC1
|
|
| MolPort-045-934-367 |
0.76 |
CC(C)[C@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)CN1CCN(C)C1=O
|
|
| MolPort-045-916-182 |
0.76 |
CC(C)C[C@@H]1NC(=O)[C@@H]2CCC[C@H]2NC(=O)[C@H](C)NC(=O)C2C[C@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)[C@H](C)O
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|
| MolPort-046-765-922 |
0.76 |
CC(C)C[C@H](NC(=O)[C@H](CCC1=CC=CC=C1)NC(=O)CN1CCOCC1)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@H](CC(C)C)C(=O)C(C)(O)CO
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|
| MolPort-046-764-449 |
0.76 |
CC(C)C[C@H](NC(=O)[C@H](CCC1=CC=CC=C1)NC(=O)CN1CCOCC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@H](CC(C)C)C(=O)C(C)(O)CO
|
|
| MolPort-046-569-869 |
0.76 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)C1=CC=CC=C1
|
|
| MolPort-046-684-183 |
0.76 |
N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O
|
|
| MolPort-045-934-664 |
0.76 |
CC(C)C[C@@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)CN1CCN(C)C1=O
|
|
| MolPort-045-932-077 |
0.76 |
CC(C)C[C@@H]1NC(=O)[C@@H]2CCC[C@H]2NC(=O)[C@H](C)NC(=O)C2C[C@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)C1CC1
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|
| MolPort-045-935-065 |
0.76 |
CC(C)C[C@@H]1NC(=O)[C@@H]2CCC[C@H]2NC(=O)[C@H](C)NC(=O)C2C[C@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CCC1CCN(C)CC1
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|
| MolPort-019-939-158 |
0.76 |
N[C@H](CCCNC(N)=N)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(O)=O
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|
| MolPort-016-581-123 |
0.76 |
N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CO)C(O)=O
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|
| MolPort-044-639-142 |
0.76 |
CO[C@H]1C[C@H]2CN([C@@H](CC3=CC=CC=C3)C(=O)N2C1)C(=O)CCC1=C(OC)C=CC=C1
|
|
| MolPort-046-569-787 |
0.76 |
CC(C)[C@H]1NC(=O)[C@@H](N)CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC1=O
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|
| MolPort-046-567-950 |
0.76 |
CC(C)CC(=O)N[C@H]1CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC(=O)[C@H](NC1=O)C(C)C
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|
| MolPort-046-568-123 |
0.76 |
CC(C)[C@H]1NC(=O)[C@H](CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC1=O)NC(=O)CC(C)(C)C1=CC=CC=C1
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| MolPort-046-568-165 |
0.76 |
CC(C)[C@H]1NC(=O)[C@H](CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC1=O)NC(=O)CCC1=CC=CC=C1
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|
| MolPort-046-567-298 |
0.76 |
CC(C)CCC(=O)N[C@H]1CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC(=O)[C@H](NC1=O)C(C)C
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|
| MolPort-046-567-195 |
0.76 |
CC(C)[C@H]1NC(=O)[C@H](CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC1=O)NC(=O)C(C)C
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0.76 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)CCCC1=CC=CS1
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|
| MolPort-046-568-303 |
0.76 |
CC(C)[C@H]1NC(=O)[C@H](CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC1=O)NC(C)=O
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|
| MolPort-046-078-529 |
0.76 |
CC(C)C(C)(O)CNC(=O)C1CCCN1C(=O)CC1=CC=CC=C1
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|
| MCULE-1482163631 |
0.76 |
CC1=CC=C(CCC(NCC(N2C3(CCCC3)C(O)CC2)=O)=O)C=C1
|
|
| MCULE-2873092105 |
0.76 |
CC(CC(NC(C(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)C(C)C)=O)C
|
|
| MCULE-8322813461 |
0.76 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)CCN1C=CC=N1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-9064755956 |
0.76 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(C1CCOCC1)=O)C
|
|
| MCULE-1216222354 |
0.76 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(N2CCN(CCCF)CC2)=O)C1
|
|
| MCULE-9677666712 |
0.76 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC([C@@H](C)O)=O
|
|
| MCULE-5310542803 |
0.76 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(C1=CC=CC=C1)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
|
|
| MCULE-1420878117 |
0.76 |
N12C[C@@H](CC1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)=O)NC(CCC1CCN(C)CC1)=O
|
|
| MCULE-1972176002 |
0.76 |
OC[C@](NC([C@](CC1=CC=CC=C1)(NC([C@](CCCNC(N)=N)(NC([C@@](N)(CCC(N)=O)[H])=O)[H])=O)[H])=O)(C(N[C@@](CCCNC(N)=N)(C(O)=O)[H])=O)[H]
|
|
| MCULE-9227615200 |
0.76 |
N12C[C@@H](CC1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)=O)NC([C@H](C)O)=O
|
|
| MCULE-2711484306 |
0.76 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC(=O)CN1CCN(C)C1=O
|
|
| MCULE-8173852270 |
0.76 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(=O)CN1CCN(C)C1=O
|
|
| MCULE-1971126410 |
0.76 |
N12C[C@@H](CC1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)=O)NC(=O)C1CC1
|
|
| MCULE-3123595818 |
0.76 |
[C@@H](NC(=O)[C@@H](N)CCCNC(=N)N)(C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CO)C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-8437062709 |
0.76 |
N12CC(CC1CN(C(CC1=CC=CC=C1)C2=O)C(=O)CCC1=CC=CC=C1OC)OC
|
|
| MCULE-1057676223 |
0.76 |
C(CCNC(N)=N)[C@H](C(N[C@@H](C(N[C@H](C(N[C@@H](CO)C(O)=O)=O)CC(O)=O)=O)CC1C=CC=CC=1)=O)N
|
|
| MCULE-6411436900 |
0.76 |
N12C[C@H](C[C@H]1CN([C@@H](CC1=CC=CC=C1)C2=O)C(=O)CCC1=CC=CC=C1OC)OC
|
|
| MCULE-9024989913 |
0.76 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(C(C)C)=O)C
|
|
| MCULE-6332747227 |
0.76 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(CCC1=CC=CC=C1)=O)C
|
|
| MCULE-4465855270 |
0.76 |
CC1C=CC(CCC(NCC(N(CC(=O)O)CCC2C=CC=CC=2)=O)=O)=CC=1
|
|
| MCULE-5351340910 |
0.76 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N(CC(=O)NCCC[C@H](N)C1=O)C
|
|
| MCULE-9016324350 |
0.76 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(CCC(C)C)=O)C
|
|
| MCULE-9609884258 |
0.76 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(=O)CC(C)(C)C1=CC=CC=C1)C
|
|
| MCULE-8968498967 |
0.76 |
CC1N(CC(N[C@@H](C(=O)O)CC2C=CC=CC=2)=O)C(C)CC1
|
|
| MCULE-8264452937 |
0.76 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(C)=O)C
|
|
| MCULE-7213560564 |
0.76 |
C1C=C(CC(NC(=O)C(C(C)C)NC(=O)C(NC(C)=O)C(C)C)C(=O)O)C=CC=1
|
|
| MCULE-4485162965 |
0.76 |
CN(C([C@H]1N(C(C)=O)CCC1)=O)CC(C1=CC=CC=C1)(O)C
|
|
| MCULE-5394741226 |
0.76 |
O=C(NC(C(N1CCCC1)=O)CC1C=CC=CC=1)CCC1CNCC1
|
|
| MCULE-9500968108 |
0.76 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(CC(C)C)=O)C
|
|
| MCULE-2416227188 |
0.76 |
CC(C(CNC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O)(O)C)C
|
|
| MCULE-5994704245 |
0.76 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(CCCC1=CC=CS1)=O)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-3047768908 |
0.76 |
CN1[C@@H](C(NC(CC(C2=CC=CC=C2)O)CO)=O)CCC1
|
|
| MCULE-4886281655 |
0.76 |
O[C@@H]1C[C@](C2=CC=CC=C2)(C(N2C[C@H]3N(C[C@@H](C3)O)CC2)=O)C1
|
|
| MCULE-4668076092 |
0.76 |
CN1C(C(NCCCC2=C(C)C=C(C)C=C2)=O)(C)CC(O)C1
|
|
| MCULE-6223856465 |
0.76 |
N1C2(CCOCC2)C(=O)N[C@H](CC2=CC=CC=C2)C1=O
|
|
| MCULE-7010579831 |
0.76 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(=O)CCOCC)C
|
|
| MCULE-9715531179 |
0.76 |
CN1C(C(NCC2(C3=CC(Cl)=CC=C3)CC2)=O)(C)CC(O)C1
|
|
| MCULE-3642547581 |
0.76 |
O[C@H]1C[C@H](C(NCC2(C3=C(Br)C=CC=C3)CC2)=O)NC1
|
|
| MCULE-3595942245 |
0.76 |
COC1C(C)(C)CN(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)CC1
|
|
| MCULE-7515747999 |
0.76 |
CC(NC1(C(N2CC(C3=CC=C(F)C=C3)(O)CC2)=O)CCCCC1)=O
|
|
| MCULE-1622978266 |
0.76 |
COCC1CN(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)C1
|
|
| MCULE-5136538606 |
0.76 |
CCCC1(CN(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)CC1)CO
|
|
| MCULE-8079577100 |
0.76 |
[C@@H](NC(=O)[C@H](CC(C)C)NC([C@@H](NC(CN1CCOCC1)=O)CCC1C=CC=CC=1)=O)(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-7743360290 |
0.76 |
CN1C(C(N[C@H]2[C@H](C3=CC(F)=C(F)C(F)=C3)C2)=O)(C)CC(O)C1
|
|
| MCULE-4314952656 |
0.76 |
CC1N(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)CCCC1
|
|
| MCULE-9373904082 |
0.76 |
C(C1C=CC=CC=1)C[C@H](NC(CN1CCOCC1)=O)C(N[C@H](C(=O)N[C@H](C(=O)O)CC1C=CC=CC=1)CC(C)C)=O
|
|
| MCULE-1868965351 |
0.76 |
CC1CN(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)CCCC1
|
|
| MCULE-2881960808 |
0.76 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC(CCC(C)(C)C)=O
|
|
| MCULE-9245929979 |
0.76 |
C(N[C@@H]([C@@H](C)CC)C(N[C@@H]([C@@H](C)CC)C(N[C@@H](CC(N)=O)C(N[C@@H](CC1=CC=CC=C1)C(N[C@@H](CCC(O)=O)C(N[C@@H](CCCCN)C(N[C@@H](CC(C)C)C(O)=O)=O)=O)=O)=O)=O)=O)([C@H](CO)N)=O
|
|
| MCULE-6519844787 |
0.76 |
C(C)(C)[C@H](C(N[C@@H](C(N1[C@H](CCC1)C(N[C@H](CC(=O)N)C(NCC(N[C@H](C(N[C@H](CCC(O)=O)C(N[C@@H](C(N[C@H](CCC(O)=O)C(N[C@@H](CO)C(N[C@H](C(N[C@@H](CCC(O)=O)C(N[C@H](C(N[C@@H](C(N1[C@@H](CCC1)C(N[C@@H](CC(C)C)C(N[C@H](CCC(O)=O)C(N[C@H](C(O)=O)CC1C=CC=CC=1)=O)=O)=O)=O)CC1C=CC=CC=1)=O)C)=O)=O)C)=O)=O)=O)CC(O)=O)=O)=O)C)=O)=O)=O)=O)CC1C=CC(O)=CC=1)=O)N
|
|
| MCULE-4338700393 |
0.76 |
C(C(O)=O)[C@H](N)C(N[C@H](CC(C)C)C(N[C@@H](C(N[C@H](C(C)C)C(N1[C@@H](CCC1)C(N[C@@H](C(N1[C@@H](CCC1)C(NCC(N[C@@H](CCCNC(N)=N)C(N[C@@H](C(N[C@H](C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](C(C)C)C(N[C@@H](CO)C(N[C@@H](C(C)C)C(N[C@@H](C(N[C@@H](C(N[C@H](CCC(O)=O)C(O)=O)=O)C)=O)C)=O)=O)=O)=O)=O)=O)CC(O)=O)=O)CC1C=CC=CC=1)=O)=O)=O)=O)[C@@H](C)CC)=O)=O)=O)CC(O)=O)=O)=O
|
|
| MCULE-6929888643 |
0.76 |
OC[C@](NC([C@@](NC([C@](CCCNC(N)=N)(NC([C@](CCCNC(N)=N)(NC([C@](CC(O)=O)(NC([C@](CC1=CC=CC=C1)(NC([C@](CCCNC(N)=N)(NC(CNC([C@@]1(CCCN1C([C@@](NC([C@@]1(CCCN1C([C@@](NC([C@](CC(O)=O)(NC([C@](CC(C)C)(NC([C@@](N)(CC(O)=O)[H])=O)[H])=O)[H])=O)(C(C)C)[H])=O)[H])=O)([C@@](C)(CC)[H])[H])=O)[H])=O)=O)[H])=O)[H])=O)[H])=O)[H])=O)[H])=O)(C(C)C)[H])=O)(C(N[C@@](C(C)C)(C(N[C@@](C)(C(N[C@@](C)(C(N[C@@](CCC(O)=O)(C(O)=O)[H])=O)[H])=O)[H])=O)[H])=O)[H]
|
|
| MCULE-2106278445 |
0.76 |
C1(=CC=CC=C1)C[C@@H](C(=O)O)NC(=O)[C@@H](N)CC1C=CC=CC=1
|
|
| MCULE-4773286510 |
0.76 |
C(O)(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC1=CC=CC=C1)N
|
|
| MCULE-3630689322 |
0.76 |
O=C([C@@H](CC1C=CC=CC=1)NC(=O)[C@@H](CC1C=CC=CC=1)N)O
|
|
| MCULE-4270439573 |
0.76 |
C(O)(=O)[C@H](CC(C)C)NC(=O)[C@H](CC1=CC=CC=C1)N
|
|
| MCULE-4590589534 |
0.76 |
CN1CCN(C(C(NC(CO)=O)CC2=CC=CC=C2)=O)CC1
|
|
| MCULE-7669128445 |
0.76 |
O=C([C@@H](CC1C=CC=CC=1)NC(=O)[C@@H](CC1C=CC=CC=1)N)O
|
|
| MCULE-4144428310 |
0.76 |
C1C=CC(CC(C(O)=O)NC(=O)C(CC2=CC=CC=C2)N)=CC=1
|
|
| MCULE-4208718548 |
0.76 |
C(C1C=CC=CC=1)C(N)C(=O)NC(C(O)=O)CC(C)C
|
|
| MCULE-6404264357 |
0.76 |
C(=O)([C@@H]1C[C@H](CN1)O)N(C1CCN(CC1)C)CCC1C=CC=CC=1
|
|
| MCULE-4508034920 |
0.76 |
CC(CC(N1C(C(NCC(C(=O)O)CC2C=CC=CC=2)=O)CCC1)=O)(C)C
|
|
| MCULE-1839534356 |
0.76 |
C1(CCCC1)(C(O)=O)NC(=O)CN1CCC(C2=CC=CC=C2)C1
|
|
| MCULE-1249806115 |
0.76 |
N1C[C@@H](C[C@@H]1C(NCCC1=CC=C(C=C1)F)=O)O
|
|
| MCULE-2314408120 |
0.76 |
COCC(C(NC(C(N1CCCC1)=O)CC1C=CC=CC=1)=O)N
|
|
| MCULE-3281776942 |
0.76 |
CCCC(N1C(C(NCC(C(=O)O)CC2C=CC=CC=2)=O)CCC1)=O
|
|
| MCULE-1857410557 |
0.76 |
OC(CCCCC(NC(C(N1CCCC1)=O)CC1C=CC=CC=1)=O)=O
|
|
| MCULE-9375896851 |
0.76 |
CC(N1[C@H](C(N2C(C(C3=CC=CC=C3)O)CCC2)=O)CCC1)=O
|
|
| MCULE-5882470179 |
0.76 |
COC(C(NC([C@H]1NCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-1248632531 |
0.76 |
CC(NC(C1NCC(O)C1)=O)CC1C=CC=C(Br)C=1
|
|
| MCULE-6078193126 |
0.76 |
COC(C(NC(C1NCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-6100046247 |
0.76 |
CO[C@H]1C[C@H](C(NC(CC2=CC=C(C(C)C)C=C2)C)=O)NC1
|
|
| MCULE-3351776463 |
0.76 |
N1(C[C@H](CC)NC(=O)[C@H](CC2=CC=CC=C2)NC([C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C1)=O)C(C1CCOCC1)=O
|
|
| MCULE-3743306202 |
0.76 |
CC(NC([C@@H]1NC[C@@H](O)C1)=O)CC1=C(Br)C=CC=C1
|
|
| MCULE-2615495972 |
0.76 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(=O)[C@@H]1CCCO1
|
|
| MCULE-8112782346 |
0.76 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(C(=O)[C@H]2CCCO2)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-5447366555 |
0.76 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(=O)[C@H]1CCCO1
|
|
| MCULE-1056793266 |
0.76 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(C(=O)[C@@H]2CCCO2)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-6308352781 |
0.76 |
N12CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@H](C(C)C)C2=O)C(=O)N1CCC(CC1)(CO)O
|
|
| MCULE-4852066360 |
0.76 |
C(=O)([C@@H]1CCCN1C)N[C@@H](CC1=CC=CC=C1)C(N)=O
|
|
| MCULE-2766183303 |
0.76 |
OCCC(C1C=CC=CC=1)CNC(C1NCCC1)=O
|
|
| MCULE-8829841708 |
0.76 |
N1(C[C@H](CC)NC(=O)[C@H](CC2=CC=CC=C2)NC([C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C1)=O)C(=O)CN(C)C
|
|
| MCULE-1023804187 |
0.76 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)NCCNCC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-6333366570 |
0.76 |
O=C(C1CCC1)NC(C(N1CCCC1)=O)CC1=CC=CC=C1
|
|
| MCULE-9040376453 |
0.76 |
N1(CCN(C(=O)C1)CCC1C=CC=CC=1)C(=O)C(O)CC(C)C
|
|
| MCULE-7405028464 |
0.76 |
N1(C[C@H](CC2=CC=CC=C2)NC(=O)C1)C(CCC1C=C(C)C=C(C)C=1)=O
|
|
| MCULE-9187569686 |
0.76 |
C(=O)(N[C@@H](C)C(N)=O)[C@H]1N(C(=O)[C@H](CC2=CC=CC=C2)N)CCC1
|
|
| MCULE-6793718226 |
0.76 |
N1(C[C@H](CC)NC(=O)[C@H](CC2=CC=CC=C2)NC([C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C1)=O)C(CN)=O
|
|
| MCULE-4818072598 |
0.76 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NCCN(C(C)=O)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-5463843646 |
0.76 |
CC(C(C1C=CC=CC=1)CC(N(C(C(=O)O)C)CCNC(=O)C)=O)C
|
|
| MCULE-6316314357 |
0.76 |
N1(C[C@H]2CCCN2C(=O)[C@@H]1C)C(=O)[C@H](CC1C=CC=CC=1)N(C)C
|
|
| MCULE-6749320576 |
0.76 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NCCN(C(CCC2=CC=CC=C2)=O)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-4604223599 |
0.76 |
NC(C1N(CCCC2=C3C(C=CC=C3)=CC=C2)CC(O)C1)=O
|
|
| MCULE-1284612459 |
0.76 |
CCC(C1C=CC=CC=1)CC(N(C(C(=O)O)C)CCNC(=O)C)=O
|
|
| MCULE-4263440311 |
0.76 |
N1(C[C@H](CC)NC(=O)[C@H](CC2C=CC=CC=2)NC([C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C1)=O)C(C)=O
|
|
| MCULE-5058565794 |
0.76 |
Cl.OC([C@@H]1N(CC(NCC2(C3=CC=CC=C3)CC2)=O)CCC1)=O
|
|
| MCULE-8760499481 |
0.76 |
N1(CC[C@H]([C@H](O)C1)C1=CC=C2C(C=CC=C2)=C1)C(=O)CN1CCCCC1=O
|
|
| MCULE-1838573968 |
0.76 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(=O)[C@@H]1CCC(=O)N1)C
|
|
| MCULE-9442794536 |
0.76 |
COCCNCC(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-9695344554 |
0.76 |
Cl.OC(C1N(CC(NCC2(C3C=CC=CC=3)CC2)=O)CCC1)=O
|
|
| MCULE-8180236181 |
0.76 |
CC(C(NC1C(=O)N(CC(O)=O)CCCC1)=O)(CC1=CC=CC=C1)C
|
|
| MCULE-3029201836 |
0.76 |
CC(NC(C1NCC(O)C1)=O)CC1C=CC=CC=1F
|
|
| MCULE-7038303489 |
0.76 |
COC1(CCC1)CC(NC(C(N1CCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-7172762626 |
0.76 |
OC(C1(CCC1)CC(NC(C(N1CCCC1)=O)CC1C=CC=CC=1)=O)=O
|
|
| MCULE-7112279009 |
0.76 |
OC1C=CC(C[C@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CC(C)C)CC(C)C)C(=O)O)=CC=1
|
|
| MCULE-1761385728 |
0.76 |
CC(NC(C(N1CC(C)(C)CC(O)CC1)=O)CC1=CC=C(O)C=C1)=O
|
|
| MCULE-6444456436 |
0.76 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)NCCN(C(=O)C2(CCC2)COC)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-7647335069 |
0.76 |
OC([C@H]1[C@@H](C2C=CC=CC=2)CN(C(CNC(CCC2CCCC2)=O)=O)C1)=O
|
|
| MCULE-4502024428 |
0.76 |
CC(NC(N1[C@H](C(NC(C(=O)O)CC2C=CC=CC=2)=O)CCC1)=O)C
|
|
| MCULE-8251842831 |
0.76 |
OC([C@H]1[C@@H](C2C=CC=CC=2)CN(C(CNC(CC2CCCCC2)=O)=O)C1)=O
|
|
| MCULE-9888543692 |
0.76 |
CC(CCC(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)=O)C
|
|
| MCULE-5501204536 |
0.76 |
OC([C@@H]1N(CC(NCC2(C3=CC=CC=C3)CC2)=O)CCC1)=O
|
|
| MCULE-7305809085 |
0.76 |
N1(C(CCCC2C=CC=CC=2)=O)[C@@H](CO)CN(C(=O)[C@@H]1C)C
|
|
| MCULE-1366308776 |
0.76 |
CC(C(=O)O)NC(C1N(C(CC2C=CC=CC=2)=O)CCC1)=O
|
|
| MCULE-5960730227 |
0.76 |
OC([C@@H]1N(CC(NCC2(C3C=CC=CC=3)CC2)=O)CCC1)=O
|
|
| MCULE-5262394190 |
0.76 |
C[C@@H](C(O)=O)NC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O
|
|
| MCULE-7131561035 |
0.76 |
CN(C(CNC(CCC1C=CC(C)=CC=1)=O)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-5059468997 |
0.76 |
OC([C@H]1N(CC(NCC2(C3C=CC=CC=3)CC2)=O)CCC1)=O
|
|
| MCULE-2599210434 |
0.76 |
CC1C=CC(CCC(NCC(NC(C(=O)O)CC2C=CC=CC=2)=O)=O)=CC=1
|
|
| MCULE-3189367565 |
0.76 |
CC1C=CC(CCC(NCC(N[C@@H](C(=O)O)CC2C=CC=CC=2)=O)=O)=CC=1
|
|
| MCULE-1299554091 |
0.76 |
OC(C1N(CC(NCC2(C3C=CC=CC=3)CC2)=O)CCC1)=O
|
|
| MCULE-5636369501 |
0.76 |
Cl.C(=O)([C@@H]1CCCN1)N1CCC(CC1)C(=O)N[C@@H](CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-1026823656 |
0.76 |
CCCC(NCC(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)=O
|
|
| MCULE-7580557383 |
0.76 |
CC(C(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)NC(C(C)(C)C)=O
|
|
| MCULE-1557420836 |
0.76 |
CN1C(C(NCC(C2=C(C)C=CC=C2)O)=O)(C)CC(O)C1
|
|
| MCULE-3523129644 |
0.76 |
CC(N(CC(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-8596253413 |
0.76 |
CC(CC(NCC(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)=O)(C)C
|
|
| MolPort-046-566-967 |
0.76 |
CCOCCC(=O)N[C@H]1CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC(=O)[C@H](NC1=O)C(C)C
|
|
| MolPort-045-918-443 |
0.76 |
O=C1NC2(CCOCC2)C(=O)N[C@@H]1CC1=CC=CC=C1
|
|
| MolPort-044-461-128 |
0.76 |
O[C@@H]1CN[C@H](C1)C(=O)NCC1(CC1)C1=CC=CC=C1Br
|
|
| MolPort-028-609-465 |
0.76 |
CNC(=O)[C@@H](CC1=CC=CC=C1)N1CCC[C@H]1C(=O)NCCOC
|
|
| MolPort-039-136-626 |
0.76 |
CC(C)C[C@H](NC(=O)[C@H](CCC1=CC=CC=C1)NC(=O)CN1CCOCC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-039-600-866 |
0.76 |
CC(=O)N1C[C@@H](O)C[C@@H]1C(=O)N1CCCC1CC(=O)C1=CC=CC=C1
|
|
| MolPort-044-449-243 |
0.76 |
CC(=O)NC1(CCCCC1)C(=O)N1CCC(O)(C1)C1=CC=C(F)C=C1
|
|
| MolPort-045-933-142 |
0.76 |
C[C@@H](O)[C@@H]1NC(=O)[C@@H]2CCC[C@H]2NC(=O)[C@H](C)NC(=O)[C@@H]2C[C@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)CCC(C)(C)C
|
|
| MolPort-016-581-049 |
0.76 |
CC[C@H](C)[C@H](NC(=O)[C@@H](N)CO)C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(O)=O
|
|
| MolPort-023-276-997 |
0.76 |
C[C@@H](O)[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(O)=O
|
|
| MolPort-019-938-992 |
0.76 |
CC(C)C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CO)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@@H](CC(O)=O)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](C)NC(=O)CNC(=O)[C@@H](CC(N)=O)NC(=O)[C@H]1CCCN1C(=O)[C@@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](N)C(C)C)C(=O)N[C@H](CCC(O)=O)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-019-939-147 |
0.76 |
CC[C@H](C)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](NC(=O)[C@@H](CC(O)=O)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](N)CC(O)=O)C(C)C)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@H](C)C(=O)N[C@H](CCC(O)=O)C(O)=O
|
|
| MolPort-016-580-998 |
0.76 |
CC[C@H](C)[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(O)=O)C(C)C)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(O)=O)C(O)=O
|
|
| MolPort-006-114-509 |
0.76 |
N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-023-334-258 |
0.76 |
N[C@H](CC1=CC=CC=C1)C(=O)N[C@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-021-762-570 |
0.76 |
CN1CCC(CC1)N(CCC1=CC=CC=C1)C(=O)[C@@H]1C[C@@H](O)CN1
|
|
| MolPort-039-048-128 |
0.76 |
OC(=O)C1(CCCC1)NC(=O)CN1CCC(C1)C1=CC=CC=C1
|
|
| MolPort-003-910-347 |
0.76 |
NC(CC1=CC=CC=C1)C(=O)NC(CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-046-747-277 |
0.76 |
OC1(CC1)C1CCN(CC1)C(=O)CN1CC(CC1=O)C1=CC=CC=C1
|
|
| MolPort-004-964-879 |
0.76 |
CC(C)C[C@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-030-053-555 |
0.76 |
O[C@H]1CN[C@H](C1)C(=O)NCCC1=CC=C(F)C=C1
|
|
| MolPort-039-293-665 |
0.76 |
CC(CC1=CC=CC(Br)=C1)NC(=O)C1CC(O)CN1
|
|
| MolPort-046-566-928 |
0.76 |
CC[C@H]1CN(CC(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N1)C(=O)C1CCOCC1
|
|
| MolPort-045-935-358 |
0.76 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2)NC1=O)[C@@H](C)O)C(=O)[C@H]1CCCO1
|
|
| MolPort-045-917-834 |
0.76 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2)NC1=O)[C@@H](C)O)C(=O)[C@@H]1CCCO1
|
|
| MolPort-045-933-039 |
0.76 |
CC(C)[C@H]1NC(=O)COC2=CC=C(C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]3CCCN3C1=O)C(=O)N1CCC(O)(CO)CC1)C=C2
|
|
| MolPort-045-933-944 |
0.76 |
CC(C)C[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](C)N(C)C1=O)C(=O)CCC1=CC=CC=C1
|
|
| MolPort-045-932-999 |
0.76 |
CC(C)C[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](C)N(C)C1=O)C(C)=O
|
|
| MolPort-046-580-068 |
0.76 |
CC[C@H]1CN(CC(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N1)C(=O)CN(C)C
|
|
| MolPort-035-673-607 |
0.76 |
C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC1=CC=CC=C1)C(N)=O
|
|
| MolPort-046-746-703 |
0.76 |
CC1=CC(CCC(=O)N2C[C@H](CC3=CC=CC=C3)NC(=O)C2)=CC(C)=C1
|
|
| MolPort-027-897-730 |
0.76 |
NC(=O)C1CC(O)CN1CCCC1=CC=CC2=CC=CC=C12
|
|
| MolPort-027-652-476 |
0.76 |
O=C(NC(CC1=CC=CC=C1)C(=O)N1CCCC1)C1CCC1
|
|
| MolPort-046-569-779 |
0.76 |
CC[C@H]1CN(CC(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N1)C(C)=O
|
|
| MolPort-046-745-736 |
0.76 |
C[C@@H]1N(C[C@H]2CCCN2C1=O)C(=O)[C@H](CC1=CC=CC=C1)N(C)C
|
|
| MolPort-046-569-029 |
0.76 |
CC[C@H]1CN(CC(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N1)C(=O)CN
|
|
| MolPort-045-953-164 |
0.76 |
CN1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(N)=O
|
|
| MolPort-038-416-216 |
0.76 |
CC(C)CC(O)C(=O)N1CCN(CCC2=CC=CC=C2)C(=O)C1
|
|
| MolPort-039-266-874 |
0.75 |
Cl.OC(=O)C1CCCN1CC(=O)NCC1(CC1)C1=CC=CC=C1
|
|
| MolPort-019-808-324 |
0.75 |
O[C@@H]1CN(CC[C@H]1C1=CC2=CC=CC=C2C=C1)C(=O)CN1CCCCC1=O
|
|
| MolPort-005-108-509 |
0.75 |
CC1(C)N(CC2(O)CCCN(CCCC3=CC=CC=C3)C2=O)CCNC1=O
|
|
| MolPort-027-865-941 |
0.75 |
CN(CC(=O)N1C[C@H]([C@@H](C1)C1=CC=CC=C1)C(O)=O)C1CCCC1
|
|
| MolPort-046-546-777 |
0.75 |
CC(C)(CC1=CC=CC=C1)C(=O)NC1CCCCN(CC(O)=O)C1=O
|
|
| MolPort-019-822-970 |
0.75 |
CCN1CCN(CC2(O)CCCN(CCC3=CC=CC=C3)C2=O)CC1=O
|
|
| MolPort-039-307-275 |
0.75 |
Cl.OC(=O)[C@H]1CCCN1CC(=O)NCC1(CC1)C1=CC=CC=C1
|
|
| MolPort-046-570-145 |
0.75 |
CC(C)[C@H]1NC(=O)[C@H](CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC1=O)NC(=O)[C@@H]1CCC(=O)N1
|
|
| MolPort-046-567-396 |
0.75 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CC1=C(C=CC=C1)C(F)(F)F
|
|
| MolPort-045-932-347 |
0.75 |
CC(C)C[C@@H]1NC(=O)[C@@H]2CCC[C@H]2NC(=O)[C@H](C)NC(=O)C2C[C@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)[C@@H]1CCCN2CCCC[C@H]12
|
|
| MolPort-045-915-349 |
0.75 |
CC(C)C[C@@H]1NC(=O)[C@@H]2CCC[C@H]2NC(=O)[C@H](C)NC(=O)C2C[C@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CC1CCCCC1
|
|
| MolPort-046-418-736 |
0.75 |
N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CO)C(O)=O
|
|
| MolPort-046-569-452 |
0.75 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CCCC1=CC=C(OC)C=C1
|
|
| MolPort-023-275-963 |
0.75 |
CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H]1CCCN1C(=O)[C@H](C)N)[C@@H](C)O)C(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](C)C(=O)NCC(=O)N[C@@H](CO)C(N)=O
|
|
| MolPort-023-276-348 |
0.75 |
CC(C)[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]1CCC(=O)NCCCC[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CC2=CC=C(O)C=C2)C(=O)N[C@@H]([C@@H](C)O)C(=O)N1)C(O)=O
|
|
| MolPort-023-276-116 |
0.75 |
CC[C@H](C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CO)[C@@H](C)O)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)CC)C(O)=O
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|
| MolPort-023-276-542 |
0.75 |
CC(C)[C@H](NC(=O)CNC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)CN)C(=O)N[C@@H](CCCNC(N)=N)C(N)=O
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| MolPort-046-566-958 |
0.75 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC1=O)NC(=O)C1=CC=NC=C1
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| MolPort-046-753-739 |
0.75 |
CC[C@@H]1NC(=O)[C@H](CC2=CC=C(OC[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H]3C[C@@H](O)CN3C1=O)C=C2)NC(=O)COC
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| MolPort-000-714-792 |
0.75 |
CC([O-])=O.CC(C)CC(NC(=O)C(CC1=CC=C(O)C=C1)NC(=O)CNC(=O)C(NC(=O)C(C)NC(=O)C([NH3+])CC1=CC=C(O)C=C1)C(C)C)C(=O)N1CCCC1C(N)=O
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|
| MolPort-027-910-002 |
0.75 |
CC(=O)N1CCCC1C(=O)NCC(O)C1=CC2=CC=CC=C2C=C1
|
|
| MolPort-044-683-823 |
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COC(=O)CC[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC1=O
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| MolPort-001-789-441 |
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CC(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC1=CC=C(O)C=C1)C(O)=O
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|
| MolPort-046-780-565 |
0.75 |
O[C@H]1C[C@H]2CN(C[C@H]2C1)C(=O)CN1CC(CC1=O)C1=CC=CC=C1
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| MolPort-039-235-307 |
0.75 |
OC1CNC(C1)C(=O)NCC1(CCCC1)C1=CC=C(F)C=C1
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|
| MolPort-039-235-304 |
0.75 |
OC1CNC(C1)C(=O)NCC1CCCC2=CC=CC=C12
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| MolPort-039-148-913 |
0.75 |
CN(CC(O)=O)C1CN(C[C@H]1O)C(=O)C1CC1C1=CC=CC=C1
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| MolPort-045-933-563 |
0.75 |
C[C@@H](O)[C@@H]1NC(=O)[C@@H]2CCC[C@H]2NC(=O)[C@H](C)NC(=O)[C@@H]2C[C@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)C1CCN(CC1)C(=O)C1CCCC1
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| MolPort-009-758-377 |
0.75 |
CC(O)=O.CC(C)C[C@H](NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(C)C)C(=O)N1CCCC1C(N)=O
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| MolPort-045-911-124 |
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O[C@H]1CN[C@@H](C1)C(=O)NCCCC1=C(F)C=CC=C1
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| MolPort-046-569-683 |
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CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CN1CCN(CC1)C1=CC(C)=CC=C1
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| MolPort-023-276-309 |
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CN([C@@H](CC1=CC=CC=C1)C(=O)N1CCC[C@H]1C(N)=O)C(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CC1=CC=C(O)C=C1
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| MolPort-045-932-563 |
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CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)C1(CN2C=CC=N2)CC1
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| MolPort-019-939-053 |
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N[C@@H](CC1=CC=C(O)C=C1)C(=O)N1CCC[C@H]1C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@H](CC1=CC=CC=C1)C(N)=O
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|
| MolPort-044-482-986 |
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CN(CC1(CC1)C1=CC=CC=C1)C(=O)CN1CCCCC(O)C1=O
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| MolPort-005-084-733 |
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CCN1CCN(CC1)C1(CC2=CC=CC=C2C1)C(=O)N1CC[C@H](O)C1
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|
| MolPort-023-276-131 |
0.75 |
CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(N)=N)[C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(N)=O
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| MolPort-028-754-068 |
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N[C@@H](CC1=CC=C(O)C=C1)C(=O)N1CCC[C@H]1C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC1=CC=CC=C1)C(N)=O
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| MolPort-046-418-553 |
0.75 |
[Na+].[Na+].[2H]C1=C([2H])C([2H])=C(CC[C@H](N[C@@H](C)C(=O)N2CCC[C@H]2C([O-])=O)C([O-])=O)C([2H])=C1[2H]
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| MolPort-046-788-544 |
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CC(C)C1NC(=O)C2CCCN2C(=O)C2CCCN2C(=O)C(CC2=CC=C(O)C=C2)NC(=O)C(CC2=CC=C(O)C=C2)NC1=O
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|
| MolPort-046-596-341 |
0.75 |
CC(C)CC(NC(=O)C(CC1=CC=C(O)C=C1)NC(=O)CNC(=O)C(NC(=O)C(C)NC(=O)C(N)CC1=CC=C(O)C=C1)C(C)C)C(=O)N1CCCC1C(N)=O
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|
| MolPort-044-639-143 |
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CO[C@H]1C[C@H]2CN([C@@H](CC3=CC=CC=C3)C(=O)N2C1)C(=O)COC1=CC(C)=CC=C1
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|
| MolPort-016-602-152 |
0.75 |
O[C@@H]1CCN2[C@@H](C1)C(=O)N(CC2=O)C1CC2=CC=CC=C2C1
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| MolPort-044-467-817 |
0.75 |
OC1CCCCN(CC(=O)NCC2(CC2)C2=CC=CC=C2)C1=O
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|
| MolPort-039-173-258 |
0.75 |
CO[C@H]1C[C@H](N(C)C1)C(=O)NC1(CC2=CC=CC=C2)CC1
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|
| MolPort-039-238-147 |
0.75 |
Cl.CC(CC1=CC=CC=C1Br)NC(=O)[C@H]1C[C@H](O)CN1
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|
| MolPort-027-679-305 |
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O=C([C@H]1CCC(=O)N1)N(CCC1=CC=CC=C1)C1CCOC1
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|
| MolPort-046-697-308 |
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OC1=CC=C(CC2NC(=O)C3CCCN3C(=O)C3CCCN3C(=O)C(CC3=CC=CC=C3)NC(=O)C(CC3=CC=C(O)C=C3)NC2=O)C=C1
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|
| MolPort-046-765-007 |
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C[C@@H]1N(C(CCC2=CC=CC=C2)C(O)=O)C(=O)C2C[C@@H]3CCC[C@@H]3N2C1=O
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| MolPort-003-847-052 |
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[Na+].[2H]C1=C([2H])C([2H])=C(CC[C@H](N[C@@H](C)C(=O)N2CCC[C@H]2C([O-])=O)C(O)=O)C([2H])=C1[2H]
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| MolPort-003-850-032 |
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OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)CCCC1=CC=C2C=CC3=C4C(C=CC1=C24)=CC=C3
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| MolPort-023-275-984 |
0.75 |
N[C@@H](CC1=CC=C(O)C=C1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC1=CC=CC=C1)C(N)=O
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|
| MolPort-039-235-380 |
0.75 |
Cl.CO[C@@H]1CN[C@H](C1)C(=O)NC(C)CC1=CC=C(C=C1)C(C)C
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|
| MCULE-6665896463 |
0.75 |
C1(CCCN(CCC2C=CC=CC=2)C1=O)(O)CN1CCN(C(=O)C1)CC
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|
| MCULE-9903031119 |
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N1(C[C@H]([C@H](C(O)=O)C1)C1C=CC=CC=1)C(=O)CN(C)C1CCCC1
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|
| MCULE-9769741419 |
0.75 |
C1(CCCN(CCCC2C=CC=CC=2)C1=O)(O)CN1CCNC(=O)C1(C)C
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|
| MCULE-1630594821 |
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C(=O)(N[C@H](C(C)C)C(O)=O)C1(C2C=CC=CC=2)CCN(CC1)C(=O)[C@@H]1CCCN1
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|
| MCULE-5221542834 |
0.75 |
CC(NC(C(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)C1CCCC1)=O
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|
| MCULE-6473790740 |
0.75 |
[C@H]1(CCCN1C(=O)[C@@H](N)CCCNC(=N)N)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N[C@@H](CO)C(=O)O)CC1C=CC=CC=1
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|
| MCULE-7892032832 |
0.75 |
N12C[C@@H](CC1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)=O)NC(CC1CCCCC1)=O
|
|
| MCULE-8900984149 |
0.75 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(CCCC1=CC=C(C=C1)OC)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
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|
| MCULE-2200296677 |
0.75 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)CC1C=CC=CC=1C(F)(F)F)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
|
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| MCULE-7366634925 |
0.75 |
N12C[C@@H](CC1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)=O)NC(=O)[C@@H]1CCCN2CCCC[C@]12[H]
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|
| MCULE-7834024242 |
0.75 |
N12C[C@@H](C[C@H]1C(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)COC1=CC=C(C=C1)C[C@H](NC(COC)=O)C(=O)N[C@@H](CC)C2=O)O
|
|
| MCULE-7367907095 |
0.75 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(C1=CC=NC=C1)=O)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
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|
| MCULE-5671729842 |
0.75 |
CC(N1C(C(NCC(C2=CC3=C(C=CC=C3)C=C2)O)=O)CCC1)=O
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|
| MCULE-7331501602 |
0.75 |
CN(C(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O)CC(O)=O
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|
| MCULE-6188911040 |
0.75 |
OC1CC(C(N2CCC(CC3C=CC=CC=3)CC2)=O)NC1
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| MCULE-2362728880 |
0.75 |
CCCN(C(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O)CC(O)=O
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|
| MCULE-9614517564 |
0.75 |
CC(C1=CC=CC=C1)(CC(N1[C@@H](CO)CN2[C@@H](CCC2)C1)=O)O
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|
| MCULE-1563799773 |
0.75 |
OC(CNC(C1N(C(CC2C=CC=CC=2)=O)CCC1)=O)=O
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|
| MCULE-5362475162 |
0.75 |
N1C[C@@H](C[C@H]1C(NCCCC1C=CC=CC=1F)=O)O
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|
| MCULE-8800334054 |
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CN1C(C(NCCCC2=CC=C(Cl)C=C2)=O)(C)CC(O)C1
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|
| MCULE-6797009612 |
0.75 |
CC(C1=CC(C(F)(F)F)=CC=C1)CCNC([C@@H]1NC[C@@H](O)C1)=O
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|
| MCULE-7615948001 |
0.75 |
C(=O)(C(CC1C=CC=CC=1)NC(C)=O)NC(CC1=CC=C(C=C1)O)C(O)=O
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|
| MCULE-1680035621 |
0.75 |
OC1CC(C(NCC2C3=C(C=CC=C3)CCC2)=O)NC1
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|
| MCULE-6223345413 |
0.75 |
CN(C1[C@H](O)CN(C(C2C(C3=CC=CC=C3)C2)=O)C1)CC(O)=O
|
|
| MCULE-1754329546 |
0.75 |
OC1CC(C(NCC2(C3=CC=C(F)C=C3)CCCC2)=O)NC1
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|
| MCULE-4190821987 |
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N1[C@H](CC2=CC=CC=C2)C(=O)N[C@@H](CCC(OC)=O)C1=O
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|
| MCULE-1303136767 |
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COCCN(C(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)C
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|
| MCULE-2128853759 |
0.75 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(NCC2(C3CC3)CCC2)=O)C1
|
|
| MCULE-9886290488 |
0.75 |
CC1(C(C2CC2)N(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)C1)C
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|
| MCULE-2500494705 |
0.75 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(NCC2(CCCC2)O)=O)C1
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|
| MCULE-8806565242 |
0.75 |
COC(CN(C(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)C)C
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|
| MCULE-1759072659 |
0.75 |
COC1CN(C(CNC(CCC2C=CC(C)=CC=2)=O)=O)C(C(=O)O)C1
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| MCULE-1355124480 |
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N12C[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(=O)C1CCN(C(C2CCCC2)=O)CC1
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|
| MCULE-6633006249 |
0.75 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(=O)C1CC1
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|
| MCULE-6685119555 |
0.75 |
CC1C(C2=CC=CC=C2)N(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)C1
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|
| MCULE-7559301701 |
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CN(C(CNC(CCC1CCCC1)=O)=O)C(C(=O)O)CC1C=CC=CC=1
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|
| MCULE-4337240354 |
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CO[C@H]1C[C@H](C(NC(CC2=CC=C(C(C)C)C=C2)C)=O)NC1.Cl
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|
| MCULE-2325802739 |
0.75 |
OC(C(NC(CNC(CC1CCCCC1)=O)=O)CC1C=CC=CC=1)=O
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|
| MCULE-2235270712 |
0.75 |
CCCC(N1C(C(NCC(C(=O)O)CC2C=CC=C3C=2C=CC=C3)=O)CCC1)=O
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|
| MCULE-8643164500 |
0.75 |
C(=O)(CN1CCCCC1)NC(CC1=CC=CC=C1)C(O)=O
|
|
| MCULE-7354259066 |
0.75 |
[C@H]1(CCCN1C(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CC1C=CC=CC=1)CC1C=CC=CC=1
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|
| MCULE-5794596289 |
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OC1C(=O)N(CC(NCC2(C3=CC=CC=C3)CC2)=O)CCCC1
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| MCULE-2894915095 |
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OC([C@H](NC(CNC(C1CCCCC1)=O)=O)CC1C=CC=CC=1)=O
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|
| MCULE-4946143472 |
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CN(C(CNC(CC1CCCCC1)=O)=O)C(C(=O)O)CC1C=CC=CC=1
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| MCULE-9256605014 |
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OC(C(NC(CNC(CCC1CCCC1)=O)=O)CC1C=CC=CC=1)=O
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|
| MCULE-3367922861 |
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C(=O)(CN1CCC(CC1)C)NC(CC1C=CC=CC=1)C(O)=O
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| MCULE-8501541960 |
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CO[C@@H]1CN(C)[C@H](C(NC2(CC2)CC2=CC=CC=C2)=O)C1
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| MCULE-4150696824 |
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N1(CC(=O)N2[C@@]([H])(C[C@@H](CC2)O)C1=O)C1CC2=C(C=CC=C2)C1
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OC([C@H](NC(CNC(CC1CCCCC1)=O)=O)CC1C=CC=CC=1)=O
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| MCULE-7911735340 |
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NC([C@@H](NC(=O)[C@H](NC(=O)[C@@H]1CCCN1C([C@@H](N)CC1=CC=C(O)C=C1)=O)CC1C=CC=CC=1)CC1C=CC=CC=1)=O
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| MCULE-3874778047 |
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OC([C@H](NC(CNC(CCC1CCCC1)=O)=O)CC1C=CC=CC=1)=O
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Cl.CC(NC([C@@H]1NC[C@@H](O)C1)=O)CC1=C(Br)C=CC=C1
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| MCULE-4050557914 |
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OC([C@H](NC(CN1C(=O)C2C(CCCC2)C1=O)=O)CC1C=CC=CC=1)=O
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|
| MCULE-8204542044 |
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N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)CN1CCN(CC1)C1=CC=CC(C)=C1)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
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| MCULE-7791505727 |
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CN1C(C(NCC2CN(CCC3=CC=CC=C3)CC2)=O)(C)CC(O)C1
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| MCULE-2412289472 |
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CC1CCN(CC(N[C@@H](C(=O)O)CC2C=CC=CC=2)=O)CC1
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| MCULE-7532660852 |
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N1(C)[C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NCCN(C(=O)COC(C)C)CC(=O)N[C@@H](CC(C)C)C1=O
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| MCULE-2204524706 |
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C1(C(CC)C)C(=O)N(C)C(CC2C=CC=CC=2)C(=O)NC(CC2C=CC(O)=CC=2)C(=O)N2CCCC2C(=O)NC(C)C(=O)N1
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| MCULE-9299424663 |
0.75 |
OC([C@H](NC(CNC(CC1CCCC1)=O)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-9083596322 |
0.75 |
N12C[C@H](C[C@H]1CN([C@@H](CC1=CC=CC=C1)C2=O)C(=O)COC1=CC=CC(C)=C1)OC
|
|
| MCULE-1412854379 |
0.75 |
CCCC(N1C(C(NCC(C(=O)O)CC2C=CC3C=CC=CC=3C=2)=O)CCC1)=O
|
|
| MCULE-5814641223 |
0.75 |
C1(CC2C(=CC=CC=2)C1)(N1CCN(CC1)CC)C(=O)N1CC[C@H](O)C1
|
|
| MCULE-6737992165 |
0.75 |
OC1CC(C(NCCC2=CC=C(Br)C=C2)=O)NC1
|
|
| MCULE-8288740293 |
0.75 |
O=C(N(C1COCC1)CCC1=CC=CC=C1)[C@@H]1NC(=O)CC1
|
|
| MCULE-4211902246 |
0.75 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(CC(=O)N[C@@H]([C@@H](C)CC)C2=O)C(=O)C1(CN2C=CC=N2)CC1)O
|
|
| MCULE-6320765918 |
0.75 |
C1(C2N(CCC2)C(=O)C(CC2C=CC=CC=2)NC(=O)C(CC2C=CC(O)=CC=2)NC(=O)C(CC2C=CC(O)=CC=2)NC(=O)C2N1CCC2)=O
|
|
| MCULE-9753139177 |
0.75 |
C(C1C=CC(O)=CC=1)[C@H](N)C(N1[C@@H](CCC1)C(N[C@@H](C(N[C@@H](C(N)=O)CC1C=CC=CC=1)=O)CC1C=CC=CC=1)=O)=O
|
|
| MCULE-8307928569 |
0.75 |
CC1C=CC=C(CC(C(=O)O)CNC(C2N(C(CC(C)(C)C)=O)CCC2)=O)C=1
|
|
| MCULE-3230382375 |
0.75 |
C(N)(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC1C=CC(O)=CC=1)N
|
|
| MCULE-4623728651 |
0.75 |
CN(C(CN1C(=O)C(O)CCCC1)=O)CC1(C2=CC=CC=C2)CC1
|
|
| MCULE-3622521587 |
0.75 |
CN1C(C(NCCC2=C(C)C=C(C)C=C2C)=O)(C)CC(O)C1
|
|
| MCULE-1418282908 |
0.75 |
CN1C(C(NCC(C2=C(C)C=C(C)C=C2)(C)C)=O)(C)CC(O)C1
|
|
| MCULE-6410119875 |
0.75 |
CN1C(C(NCCC2=CC(O)=CC=C2)=O)(C)CC(O)C1
|
|
| MCULE-7340494737 |
0.75 |
CCCC(N1C(C(NCC(C(=O)O)CC2C=CC=C(C)C=2)=O)CCC1)=O
|
|
| MCULE-6228769747 |
0.75 |
N12CCC[C@@H]1C(=O)N[C@H](CC(C)C)C(=O)N[C@H]1CCO[C@@H]([C@H]1O)CN(C(C1CCOCC1)=O)CC(=O)N[C@@H](CC1C=CC=CC=1)C2=O
|
|
| MCULE-6030031967 |
0.75 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(CC1=CC(OC)=C(C(OC)=C1)OC)=O)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-4178886911 |
0.75 |
C1(=O)[C@@H]2CCCN2C(=O)CN(C[C@H]2OCC[C@@H]([C@@H]2O)NC(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@H](C)N1C)C(C1CCOCC1)=O
|
|
| MCULE-1814583967 |
0.75 |
CC(C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@H](CC(=O)O)N)CCCNC(=N)N)CC(C)C)CC1C=CC(O)=CC=1)CO)CC1C=CC=CC=1)C(=O)N)C
|
|
| MCULE-9109290857 |
0.75 |
[C@H](C(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N)CC(C)C)CC1C=CC=CC=1)(NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@@H](N)CC(=O)O)CC1C=CC(O)=CC=1
|
|
| MCULE-7906881977 |
0.75 |
C(C(O)=O)[C@H](N)C(N[C@H](CCCNC(N)=N)C(N[C@H](CC(C)C)C(N[C@@H](C(N[C@@H](CO)C(N[C@@H](C(NCC(N[C@@H](CC(C)C)C(N)=O)=O)=O)CC1C=CC=CC=1)=O)=O)CC1C=CC(O)=CC=1)=O)=O)=O
|
|
| MCULE-5388246737 |
0.75 |
N12C[C@@H](CC1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)=O)NC(=O)CCOC
|
|
| MCULE-9755934408 |
0.75 |
N1(CCCC1C(O)=O)C(=O)C(CC1=CC=CC=C1)NC(C1C=CC=CC=1)=O
|
|
| MCULE-7779735228 |
0.75 |
COC1CN(C(CN(C(=O)C)CCC2C=CC=CC=2)=O)C(C(=O)O)C1
|
|
| MCULE-3178711740 |
0.75 |
C(=O)(CC([H])(CNC(=O)C1CCCN1)C1C=CC(=CC=1)Cl)NC(CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-9948995552 |
0.75 |
CN1C(C(NCC(C(F)(F)F)(C2=CC=CC=C2)O)=O)(C)CC(O)C1
|
|
| MCULE-7110043221 |
0.75 |
OC1C(CCC2=CC=CC=C2)N(C([C@H]2NC(=O)CC2)=O)CCC1
|
|
| MCULE-8822510275 |
0.75 |
C1(CCCN(CCC2C=CC=CC=2)C1=O)(O)CN1CCN(C(=O)C1)C1CCCC1
|
|
| MCULE-4007767060 |
0.75 |
C(=O)(N[C@H](C(C)C)C(O)=O)C1(C2C=CC=CC=2)CCN(CC1)C(=O)[C@@H]1CCCN1.Cl
|
|
| MCULE-8799096790 |
0.75 |
C1(C2=CC=CC=C2)(CC1)C(=O)N1CCC(CC1)N1C[C@@H](C[C@H]1C(N)=O)O
|
|
| MCULE-8388559868 |
0.75 |
CC1C=CC(CCC(NCC(N2C[C@@H](C3C=CC=CC=3)[C@@H](C(=O)O)C2)=O)=O)=CC=1
|
|
| MCULE-2550197185 |
0.75 |
C1(C2=CC=CC=C2)(CC1)C(=O)N1CCC(CC1)N1CC(CC1C(N)=O)O
|
|
| MCULE-3748925258 |
0.75 |
COC1(CCC1)CC(NC(C(N1CCCCC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-3406602681 |
0.75 |
C1(N(C)CCC2=CC=CC=C2)(CC2C(=CC=CC=2)C1)C(=O)N1CC[C@H](O)C1
|
|
| MCULE-8916761254 |
0.75 |
CC(C(=O)O)(CNC(C1N(C(CC2C=CC=CC=2)=O)CCC1)=O)O
|
|
| MCULE-4977003281 |
0.75 |
N1(CC(O)CN(CCC2=CC=CC=C2)C(=O)C1)C(CCC1=CC=CC=C1)=O
|
|
| MCULE-8884520090 |
0.75 |
C(=O)(CN1CCC(O)(C2C=CC=CC=2)C1)N1CCCCCC1
|
|
| MCULE-4502336417 |
0.75 |
CN1C(=O)CN(C(CC(C2=CC=CC=C2)(C)C)=O)C(C(O)=O)C1
|
|
| MCULE-9345596192 |
0.75 |
C(=O)([C@@H](N)CC1C=CC=CC=1)N1CCC(CC1)C(=O)NCC(=O)NCC(O)=O
|
|
| MCULE-4480202454 |
0.75 |
CN1C(=O)CN(C(CCC2=CC=CC=C2)=O)C(C(O)=O)C1
|
|
| MCULE-1619208728 |
0.75 |
CC(CC(NCC(NC(C(=O)O)CC1C=CC=CC=1)=O)=O)(C)C
|
|
| MCULE-8513795702 |
0.75 |
CN(C(CNC(CC(C)(C)C)=O)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-8224844702 |
0.75 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NCCN(C(=O)C2CC2)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-5952475326 |
0.75 |
CC(C[C@@H](C(=O)O)NC(CNC(C(CC1C=CC=CC=1)(C)C)=O)=O)C
|
|
| MCULE-6521157369 |
0.75 |
CC(CC(NCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)=O)(C)C
|
|
| MCULE-5724241010 |
0.75 |
CC(C[C@@H](C(=O)O)NC(CNC(CCC1C=CC=CC=1)=O)=O)C
|
|
| MCULE-2009240209 |
0.75 |
N1(CC[C@@]([C@@H](O)C1)(C)O)C(=O)CN1CCC(CC1)C1C=CC=CC=1
|
|
| MCULE-9130341015 |
0.75 |
N1(C[C@H](CC)NC(=O)[C@H](CC2=CC=CC=C2)NC([C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C1)=O)C(C1CCC1)=O
|
|
| MCULE-6797312946 |
0.75 |
CCCC(NCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)=O
|
|
| MCULE-6963738080 |
0.75 |
C1(C)(C)C(C1(C)C)C(=O)N1CCNC(=O)[C@H](CC2=CC=CC=C2)NC([C@H](C)N(C)C(=O)[C@H](CC(C)C)NC(=O)C1)=O
|
|
| MCULE-8960814595 |
0.75 |
CCC(C(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)N(CC)CC
|
|
| MCULE-2233651071 |
0.75 |
CCCC(NCC(N(C(C(=O)O)CC1C=CC=CC=1)C)=O)=O
|
|
| MCULE-4810886411 |
0.75 |
CC(C[C@@H](C(=O)O)NC(CNC(CC(C1C=CC=CC=1)(C)C)=O)=O)C
|
|
| MCULE-6464912209 |
0.75 |
N1(CCN(C(=O)C1)CCC1C=CC=CC=1)C(=O)CN1CCCC(O)C1
|
|
| MCULE-5863018450 |
0.75 |
CCCC(NCC(NC(C(=O)O)CC1C=CC=CC=1)=O)=O
|
|
| MCULE-5216331151 |
0.75 |
C(N[C@@H]([C@@H](C)CC)C(N[C@@H]([C@@H](C)CC)C(N[C@@H](CC(N)=O)C(N[C@@H](CC1=CC=CC=C1)C(N[C@@H](CCC(O)=O)C(N[C@@H](CCCCN)C(N[C@@H](CC(C)C)C(O)=O)=O)=O)=O)=O)=O)=O)([C@H](CO)N)=O.OC(=O)C(F)(F)F
|
|
| MCULE-8069384390 |
0.75 |
O[C@H]1[C@@H](C[C@](C(=O)N[C@H](CC2C=CC=CC=2)C(N)=O)(C[C@@H]1NC(CC1(CC(O)=O)CCCC1)=O)O)O
|
|
| MCULE-2661380880 |
0.75 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(C1CCCCC1)=O
|
|
| MCULE-7137782180 |
0.75 |
CCC1=C([C@H]2[C@H](C(N3[C@H](C(N4CCCC4)=O)C[C@H](OC)C3)=O)C2)C=CC=C1
|
|
| MCULE-9204976617 |
0.75 |
[C@@H]1(C(O)=O)CN(C[C@H]1C1C=CC=CC=1C)C(=O)CN1CCCCC1=O
|
|
| MCULE-4838109487 |
0.75 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(NC2CC3(CC3)CCC2)=O)C1
|
|
| MCULE-1967390677 |
0.75 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(N2CC3CC(CCC3)C2)=O)C1
|
|
| MCULE-1426153951 |
0.75 |
COC1(CCC1)CC(NC(C(N1CCOCC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-3110681657 |
0.75 |
C(=O)(C(CC1C=CC=CC=1)NC([C@@]([H])(C)N)=O)N[C@]([H])(CC(C)C)C(=O)N[C@@]([H])(CCCNC(N)=N)C(O)=O
|
|
| MCULE-5688221637 |
0.75 |
OC([C@H]1[C@H](C2=CC=C(Cl)C=C2)CN(C(CN2C(=O)CCCC2)=O)C1)=O
|
|
| MCULE-2698295095 |
0.75 |
C(=O)(C(CC1C=CC=CC=1)NC(C(C)N)=O)NC(CC(C)C)C(=O)NC(CCCNC(N)=N)C(O)=O
|
|
| MCULE-8460615456 |
0.75 |
OCCCC1CCN(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)CC1
|
|
| MCULE-7350156075 |
0.75 |
OCC(NC(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)CCF
|
|
| MCULE-7718396144 |
0.75 |
N12CCC[C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CN(C(=O)[C@H]1CCCO1)CC(=O)N[C@@H](C)C2=O)CC1C=CC=CC=1
|
|
| MCULE-3930580205 |
0.75 |
COC1(CN(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)C1)C
|
|
| MCULE-8678753104 |
0.75 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(N2CCC3(CCCC3)CC2)=O)C1
|
|
| MCULE-1877772659 |
0.75 |
CN(C(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)CCCN1CCCC1
|
|
| MCULE-4842150475 |
0.75 |
COCC1(CN(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)C1)O
|
|
| MCULE-6192551037 |
0.75 |
CCC1(CN(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)CCC1)CO
|
|
| MCULE-6839129716 |
0.75 |
C(=O)(N[C@@H](CCC(O)=O)C(O)=O)C1(C2C=CC=CC=2)CCN(CC1)C(=O)[C@@H]1CCCN1
|
|
| MCULE-7813683489 |
0.75 |
C(=O)(C[C@@]([H])(CNC(=O)[C@@H]1CCCN1)C1=CC=C(C=C1)Cl)N[C@@H](C)C(O)=O.Cl
|
|
| MCULE-1185449350 |
0.75 |
C(=O)(CC([H])(CNC(=O)C1CCCN1)C1=CC=C(C=C1)Cl)NC(C)C(O)=O
|
|
| MCULE-6902296293 |
0.75 |
C1(C[C@H]2C(=O)N3CCC[C@]3([H])C(=O)N[C@@H](CCCCCC(=O)[C@H]3OC3)C(=O)NC(C)(C)C(=O)N2)C=CC=CC=1
|
|
| MCULE-3450154329 |
0.75 |
OC1CC(C(NCC2(C3C=CC=C(Br)C=3)CCC2)=O)NC1
|
|
| MCULE-4496748803 |
0.75 |
C(=O)(C[C@@]([H])(CNC(=O)[C@@H]1CCCN1)C1=CC=C(C=C1)Cl)N[C@@H](C)C(O)=O
|
|
| MCULE-6796748996 |
0.75 |
COC1(CCC1)CC(NC(C(N(C)C)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-7572514905 |
0.75 |
O=C([C@@H](N)CC1C=CC(O)=CC=1)N[C@H](C(=O)N[C@H](C(=O)O)CC1C=CC(O)=CC=1)CC1C=CC(O)=CC=1
|
|
| MCULE-8845637135 |
0.75 |
CC(C1=CC(C(F)(F)F)=CC=C1)CCNC([C@@H]1NC[C@@H](O)C1)=O.Cl
|
|
| MolPort-046-567-715 |
0.75 |
COC1=CC(CC(=O)N[C@H]2CCCNC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@H](C)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC3=CC=CC=C3)NC2=O)=CC(OC)=C1OC
|
|
| MolPort-044-649-353 |
0.75 |
CC(C)C[C@H](NC(=O)CNC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CO)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CC(O)=O)C(N)=O
|
|
| MolPort-046-567-928 |
0.75 |
CC(C)C[C@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](CC2=CC=CC=C2)NC(=O)CN(C[C@H]2OCC[C@H](NC1=O)[C@@H]2O)C(=O)C1CCOCC1
|
|
| MolPort-046-568-366 |
0.75 |
C[C@@H]1N(C)C(=O)[C@@H]2CCCN2C(=O)CN(C[C@H]2OCC[C@H](NC(=O)[C@H](CC3=CC=CC=C3)NC1=O)[C@@H]2O)C(=O)C1CCOCC1
|
|
| MolPort-019-939-157 |
0.75 |
CC(C)C[C@H](NC(=O)CNC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H](CO)NC(=O)[C@@H](CC1=CC=C(O)C=C1)NC(=O)[C@@H](CC(C)C)NC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@@H](N)CC(O)=O)C(N)=O
|
|
| MolPort-038-393-389 |
0.75 |
OC1CCCN(CC(=O)N2CCN(CCC3=CC=CC=C3)C(=O)C2)C1
|
|
| MolPort-000-835-985 |
0.75 |
Cl.OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C[C@@H](CNC(=O)[C@@H]1CCCN1)C1=CC=C(Cl)C=C1
|
|
| MolPort-028-609-466 |
0.75 |
CNC(=O)[C@@H](CC1=CC=CC=C1)N1CCC[C@H]1C(=O)N1CCN(C)CC1
|
|
| MolPort-044-367-841 |
0.75 |
NC(=O)[C@@H]1C[C@@H](O)CN1C1CCN(CC1)C(=O)C1(CC1)C1=CC=CC=C1
|
|
| MolPort-002-532-996 |
0.75 |
CCC(C)[C@H](NC(=O)C1(CCN(CC1)C(=O)[C@@H]1CCCN1)C1=CC=CC=C1)C(O)=O
|
|
| MolPort-044-713-011 |
0.75 |
OC1(CCN(CC(=O)N2CCCCCC2)C1)C1=CC=CC=C1
|
|
| MolPort-002-671-205 |
0.75 |
OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C[C@@H](CNC(=O)[C@@H]1CCCN1)C1=CC=C(Cl)C=C1
|
|
| MolPort-046-782-764 |
0.75 |
CCCC(=O)N1CC[C@@](O)([C@@H](C1)N1CCCC1)C1=CC=CC=C1
|
|
| MolPort-029-888-335 |
0.75 |
C[C@@]1(O)CCN(C[C@@H]1O)C(=O)CN1CCC(CC1)C1=CC=CC=C1
|
|
| MolPort-000-826-267 |
0.75 |
Cl.CCC(C)[C@H](NC(=O)C[C@@H](CNC(=O)[C@@H]1CCCN1)C1=CC=C(Cl)C=C1)C(O)=O
|
|
| MolPort-002-670-053 |
0.75 |
CCC(C)[C@H](NC(=O)C[C@@H](CNC(=O)[C@@H]1CCCN1)C1=CC=C(Cl)C=C1)C(O)=O
|
|
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0.75 |
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OC(=O)[C@@H]1CN(C[C@H]1C1=CC=CC=C1)C(=O)CN1CCCCCC1
|
|
| MolPort-028-590-050 |
0.74 |
COCC(=O)N1CCC(CC1)C(=O)N1CCNC(=O)C1CC1=CC=CC=C1
|
|
| MolPort-044-476-407 |
0.74 |
OC1CCCCN(CC(=O)N2CCC(O)(CC2)C2=CC=CC=C2)C1=O
|
|
| MCULE-6178218545 |
0.74 |
O=C(C[C@@H]1NC(=O)CNC(=O)[C@H](CCC/N=C(\N)/N)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@@H](CC2C=CC=CC=2)NC1=O)O
|
|
| MCULE-8418977730 |
0.74 |
C(C1C=CC=CC=1)[C@H]1NC([C@@H](NC([C@]([H])(CCNC([C@]([H])([C@H](O)C)NC(=O)[C@H](CCN)NC(=O)[C@]([H])(CCN)NC(=O)[C@H](CC(C)C)NC1=O)=O)NC(=O)[C@H](CCN)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCN)NC(=O)CCCC[C@@H](C)CC)=O)CCN)=O.C(C1C=CC=CC=1)[C@H]1NC([C@@H](NC([C@]([H])(CCNC([C@]([H])([C@H](O)C)NC(=O)[C@H](CCN)NC(=O)[C@]([H])(CCN)NC(=O)[C@H](CC(C)C)NC1=O)=O)NC(=O)[C@H](CCN)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CCN)NC(=O)CCCCC(C)C)=O)CCN)=O.S(O)(O)(=O)=O
|
|
| MCULE-6047935534 |
0.74 |
CCC(CCCCC(NC(C(NC(C(NC(C(NC1C(=O)NC(CCN)C(=O)NC(CC2C=CC=CC=2)C(=O)NC(CC(C)C)C(=O)NC(CCN)C(=O)NC(CCN)C(=O)NC(C(O)C)C(=O)NCC1)=O)CCN)=O)C(O)C)=O)CCN)=O)C.OS(O)(=O)=O
|
|
| MCULE-8298258877 |
0.74 |
CN1C(C(NCC2(C3C=CC=CC=3CC2)O)=O)(C)CC(O)C1
|
|
| MCULE-7495700963 |
0.74 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(=O)C1(CCCCC1)N1CCOCC1)C
|
|
| MCULE-7764340883 |
0.74 |
CCC1(C(NC(C(OC)=O)CC2C=CC=CC=2)=O)NCCC1
|
|
| MCULE-9882724951 |
0.74 |
CO[C@@H]1CN(C)[C@H](C(N2CCC(C3=CC=CC=C3)(O)CC2)=O)C1
|
|
| MCULE-2329510296 |
0.74 |
N1(C[C@H]([C@H](C(O)=O)C1)C1=CC=CC=C1)C(=O)CN(C)CCOC
|
|
| MCULE-7097331840 |
0.74 |
CC1C(NC(C(N2CCCCC2)=O)CC2=CC=CC=C2)CCO1
|
|
| MCULE-4396885413 |
0.74 |
N1(C[C@H]([C@H](C(O)=O)C1)C1C=CC=CC=1)C(=O)C1(CCCC1)N1CCCC1
|
|
| MCULE-3434203242 |
0.74 |
Cl.OC1CC(C(NCCC2=CC=C(Br)C=C2)=O)NC1
|
|
| MCULE-9934795048 |
0.74 |
CC(C(NC1CCCC1)=O)N1C[C@H](C2=CC=CC=C2)[C@@H](C(O)=O)C1
|
|
| MCULE-5674638102 |
0.74 |
CCCCC(C(O)=O)NC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O
|
|
| MCULE-7251008165 |
0.74 |
Cl.CC(C1=CC=C(Cl)C=C1)(CNC(C1NCC(O)C1)=O)C
|
|
| MCULE-3225600936 |
0.74 |
N12CC[C@H](C[C@@]1([H])C(N(CCC(C1=CC=CC=C1)C1=CC=CC=C1)CC2=O)=O)O
|
|
| MCULE-1816325507 |
0.74 |
CCC1(C2=CC=CC=C2)CN(C(CN2C(=O)C(O)CCCC2)=O)C1
|
|
| MCULE-8233164524 |
0.74 |
CC(C1=CC=C(Cl)C=C1)(CNC(C1NCC(O)C1)=O)C
|
|
| MCULE-9593466829 |
0.74 |
N1(CC(=O)N2[C@@]([H])(C[C@@H](CC2)O)C1=O)CC(C1C=CC=CC=1)C1C=CC=CC=1
|
|
| MCULE-6536653282 |
0.74 |
N1[C@H](CC2C=CC(=CC=2)O)C(=O)N[C@@H](CCCN)C1=O
|
|
| MCULE-8528541346 |
0.74 |
COCC(N[C@H](C(N1C(C)CC(C2=CC=CC=C2)C1)=O)C(C)C)=O
|
|
| MCULE-5727574235 |
0.74 |
Cl.OC1CC(C(NCCC2=CC=C(Cl)C=C2)=O)NC1
|
|
| MCULE-2707834077 |
0.74 |
OC1CC(C(NCCC2=CC=C(Cl)C=C2)=O)NC1
|
|
| MCULE-7523821999 |
0.74 |
OC1CC(C(NCCC2=C(F)C=CC=C2)=O)NC1
|
|
| MCULE-8020560257 |
0.74 |
OC(C1CCC(C(NC(C(N2CCCC2)=O)CC2=CC=CC=C2)=O)CC1)=O
|
|
| MCULE-3969466554 |
0.74 |
OC([C@H](NC(CN1C(=O)CCC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-6377045799 |
0.74 |
OC(C(NC(CN1C(=O)CCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-6186422458 |
0.74 |
OC[C@H]1N(CC(NCC2(C3=CC=CC=C3)CC2)=O)C[C@H](O)C1
|
|
| MCULE-4566532134 |
0.74 |
OC([C@@H](NC(CN1C(=O)CCC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-2628596647 |
0.74 |
N1C2(CCCC2)C(=O)N[C@@H](CC2C=CC=CC=2)C1=O
|
|
| MCULE-3082727981 |
0.74 |
N1C2(CCCC2)C(=O)N[C@H](CC2=CC=CC=C2)C1=O
|
|
| MCULE-8365394131 |
0.74 |
CCCC(C(NC(C(=O)O)CC)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-4280982570 |
0.74 |
OC([C@H](NC(CN1C(=O)CCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-3110364649 |
0.74 |
O=C(NC(C(NC1CC1)=O)CC1C=CC=CC=1)CCC1CNCC1
|
|
| MCULE-9336640731 |
0.74 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)C1C=CC3=C(C=CC=N3)C=1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-1873125107 |
0.74 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(=O)C1C=CC(=C(F)C=1)F)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-8494595693 |
0.74 |
N12C[C@@H](C[C@H]1C(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)COC1C=CC(=CC=1)C[C@@H](C(=O)N[C@@H](CC)C2=O)NC(C1CCCC1)=O)O
|
|
| MCULE-4544361247 |
0.74 |
C1(=O)[C@@H]2CCCN2C(=O)CN(CC(C)C)C[C@H]2OCC[C@@H]([C@@H]2O)NC(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@H](C)N1C
|
|
| MCULE-6780279665 |
0.74 |
N12CCC[C@@H]1C(=O)N[C@H](CC(C)C)C(=O)N[C@H]1CCO[C@@H]([C@H]1O)CNCC(=O)N[C@@H](CC1C=CC=CC=1)C2=O
|
|
| MCULE-7868898513 |
0.74 |
N12CCC[C@@H]1C(=O)N[C@H](CC(C)C)C(=O)N[C@H]1CCO[C@@H]([C@H]1O)CN(CCCC)CC(=O)N[C@@H](CC1=CC=CC=C1)C2=O
|
|
| MCULE-9472435820 |
0.74 |
N12C[C@@H](C[C@H]1C(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)COC1=CC=C(C=C1)C[C@H](N)C(=O)N[C@@H](CC)C2=O)O
|
|
| MCULE-4745070093 |
0.74 |
C1(=O)[C@@H]2CCCN2C(CNC[C@H]2OCC[C@@H]([C@@H]2O)NC(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@H](C)N1C)=O
|
|
| MCULE-8145094595 |
0.74 |
CC(N1[C@@H](C(N[C@H]2[C@H](C3=CC=CC=C3)OCC2)=O)C[C@@H](O)C1)=O
|
|
| MCULE-8272864220 |
0.74 |
[C@H](NC(=O)[C@H](CC(C)C)NC([C@H](NC(CN1CCOCC1)=O)CCC1C=CC=CC=1)=O)(C(=O)N[C@@H](C([C@]1(CO1)C)=O)CC(C)C)CC1C=CC=CC=1
|
|
| MCULE-2243106007 |
0.74 |
[C@@H](NC(=O)[C@@H](CC(C)C)NC([C@H](NC(CN1CCOCC1)=O)CCC1C=CC=CC=1)=O)(C(=O)N[C@@H](C([C@]1(CO1)C)=O)CC(C)C)CC1C=CC=CC=1
|
|
| MCULE-4816093721 |
0.74 |
[C@@H](NC(=O)[C@@H](CC(C)C)NC([C@H](NC(CN1CCOCC1)=O)CCC1C=CC=CC=1)=O)(C(=O)N[C@H](C([C@@]1(CO1)C)=O)CC(C)C)CC1C=CC=CC=1
|
|
| MCULE-1147901983 |
0.74 |
C(N[C@@H](CC1=CC=CC=C1)C(N[C@@H](CC(C)C)C([C@@]1(C)CO1)=O)=O)(=O)[C@@H](NC(=O)[C@@H](NC(=O)CN1CCOCC1)CCC1=CC=CC=C1)CC(C)C
|
|
| MCULE-3647676325 |
0.74 |
O1CCN(CC(N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)[C@]2(C)CO2)CC(C)C)CC2C=CC=CC=2)CC(C)C)CCC2C=CC=CC=2)=O)CC1
|
|
| MCULE-5022890635 |
0.74 |
[C@H](NC(=O)[C@@H](CC(C)C)NC([C@@H](NC(CN1CCOCC1)=O)CCC1C=CC=CC=1)=O)(C(=O)N[C@H](C([C@]1(CO1)C)=O)CC(C)C)CC1C=CC=CC=1
|
|
| MCULE-5568029749 |
0.74 |
CC(C[C@@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)[C@]1(CO1)C)CC(C)C)CC1C=CC=CC=1)NC(=O)[C@H](CCC1C=CC=CC=1)NC(=O)CN1CCOCC1)C
|
|
| MCULE-9124626929 |
0.74 |
[C@H](NC(=O)[C@@H](CC(C)C)NC([C@@H](NC(CN1CCOCC1)=O)CCC1C=CC=CC=1)=O)(C(=O)N[C@@H](C([C@]1(CO1)C)=O)CC(C)C)CC1C=CC=CC=1
|
|
| MCULE-1432008667 |
0.74 |
CC(NC(N1[C@H](C(N2C[C@@H](C3C=CC=CC=3)[C@@H](C(=O)O)C2)=O)CCC1)=O)C
|
|
| MCULE-7056102411 |
0.74 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(=O)[C@@H]1CCCO1)C
|
|
| MCULE-1559066537 |
0.74 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(=O)[C@H]1CCCO1)C
|
|
| MCULE-8610236772 |
0.74 |
N12C[C@H](C[C@H]1CN([C@@H](C)C2=O)C(CCC1C=CC(=CC=1)OC)=O)OC
|
|
| MCULE-6302135979 |
0.74 |
C1C2C(CC1N1CC3(C1)N1C[C@@H](C[C@H]1C(=O)N(CCCC)C3=O)O)=CC=CC=2
|
|
| MCULE-3983521463 |
0.74 |
C(N)(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H]([C@H](O)C)N
|
|
| MCULE-9753454056 |
0.74 |
C12(CC3CC(CC(C3)C1)C2)C(=O)NC(CC1C=CC=CC=1)C(=O)NC(CC1C=CC=CC=1)C(OC)=O
|
|
| MCULE-2930350374 |
0.74 |
[C@@H](O)(C)[C@H](C(N[C@@H](C(N[C@@H](CC(C)C)C(N[C@@H](CC(C)C)C(N[C@@H](CCCNC(N)=N)C(N)=O)=O)=O)=O)CC1C=CC=CC=1)=O)N
|
|
| MCULE-1402088390 |
0.74 |
[C@@H](NC(=O)[C@H](CC(C)C)NC([C@@H](N)CCC1C=CC=CC=1)=O)(C(=O)OC)CC1C=CC=CC=1
|
|
| MCULE-5819724182 |
0.74 |
C(OC)(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](N)CCC1=CC=CC=C1)CC(C)C)CC1=CC=CC=C1
|
|
| MCULE-3545865313 |
0.74 |
COC(C1=CC=CC=C1)CNC(C1NCC(O)C1)=O
|
|
| MCULE-6297163097 |
0.74 |
N1(CCNC(=O)C1CC1C=CC=CC=1)C(=O)C1CCN(CC1)C(COC)=O
|
|
| MCULE-4617667145 |
0.74 |
CC1=CC=C(CC(NC(C2N(C3CCOCC3)CCC2)=O)CO)C=C1
|
|
| MCULE-1157019789 |
0.74 |
OC([C@H]1[C@@H](C2C=CC=CC=2)CN(C(CNC(CC2C=CC=CC=2)=O)=O)C1)=O
|
|
| MCULE-3532616638 |
0.74 |
CCC1C=CC(C(N(C)C)CNC(C2NCC(O)C2)=O)=CC=1
|
|
| MCULE-3874021291 |
0.74 |
OC1C(=O)N(CC(N2CCC(C3=CC=CC=C3)(O)CC2)=O)CCCC1
|
|
| MCULE-9307118357 |
0.74 |
N1(C[C@H]([C@H](C(O)=O)C1)C1C=CC=CC=1)C(=O)CN1CCCCCC1
|
|
| MCULE-4234067895 |
0.74 |
C(=O)([C@@H](N)CC1=CC=CC=C1)N1CCC(CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MCULE-1600160525 |
0.74 |
C(=O)(C(CC1C=CC(=CC=1)F)NC(C)=O)NC(C)C(O)=O
|
|
| MCULE-6794943958 |
0.74 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(=O)C1(CCCC1)N1CCCC1)C
|
|
| MCULE-8691488249 |
0.74 |
N1(CC[C@]([C@H](N2CCCC2)C1)(O)C1=CC=CC=C1)C(=O)C1CC1
|
|
| MCULE-7653180238 |
0.74 |
NCCC1(CCN(C(C2C(C3=CC=CC=C3)CCCN2)=O)CC1)O
|
|
| MCULE-5796268794 |
0.74 |
CCOCCCC(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-8305889124 |
0.74 |
O[C@@H]1[C@H](O)C[C@H](NC(C2N(C(CC3=CC=CC=C3)=O)CCC2)=O)C1
|
|
| MCULE-6430059095 |
0.74 |
N1[C@@H](CC2C=CC=CC=2)C(=O)N[C@@H](CCCNC(N)=O)C1=O
|
|
| MCULE-8124728898 |
0.74 |
N1(CCCC1C(=O)O)C(=O)C(C)NC(C(O)=O)CCC1=CC=CC=C1
|
|
| MCULE-3507396113 |
0.74 |
C[C@@H](C(N1[C@H](C(O)=O)CCC1)=O)N[C@H](C(O)=O)CCC1=CC=CC=C1
|
|
| MCULE-7510538619 |
0.74 |
O=C(O)[C@@H]1CCCN1C(=O)[C@H](C)N[C@@H](CCC1C=CC=CC=1)C(=O)O
|
|
| MCULE-5195393121 |
0.74 |
CN1C(=O)CN(C(CCC2=CC3=C(C=CC=C3)C=C2)=O)C(C(O)=O)C1
|
|
| MCULE-5669646366 |
0.74 |
CCN1CCN(C(C(NC(C(OC)C)=O)CC2=CC=CC=C2)=O)CC1
|
|
| MCULE-6567243494 |
0.74 |
C(CCNC(N)=N)[C@@H](C(N[C@H](CCCCN)C(N[C@@H](C(N[C@@H](CO)C(N[C@H](C(N[C@@H](CO)C(N[C@@H](CCC(O)=O)C(N[C@H](C(N[C@@H](C(N[C@H](CCCNC(N)=N)C(N1[C@@H](CCC1)C(N[C@@H](CC(C)C)C(N[C@@H](CCCNC(N)=N)C(O)=O)=O)=O)=O)=O)CC(O)=O)=O)CC1C=CC=CC=1)=O)=O)=O)C)=O)=O)[C@@H](C)CC)=O)=O)N
|
|
| MCULE-3842025940 |
0.74 |
CC(CCC(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)=O)N
|
|
| MCULE-4589215257 |
0.74 |
CC(C[C@@H](C(=O)O)NC(CNC(CCC1C=CC=C(C)C=1)=O)=O)C
|
|
| MCULE-3252912397 |
0.74 |
N(C1CC1C1C=CC=CC=1)C(C1CCC(=O)N1)=O
|
|
| MCULE-5642534707 |
0.74 |
CN1CCC(C2=CC=CC=C2)(CNC(C2N(C(C(C)(C)C)=O)CCC2)=O)CC1
|
|
| MCULE-6488839906 |
0.74 |
C[C@]1(C(N2CC(CC3=CC=CC=C3)NCC2)=O)NC(=O)CC1
|
|
| MCULE-5898835952 |
0.74 |
CCCN1C(C(NCC(CC2=CC=CC=C2)O)=O)CCC1
|
|
| MCULE-2749890952 |
0.74 |
CC(C[C@@H](C(=O)O)NC(CNC(CCC1C=CC2C=CC=CC=2C=1)=O)=O)C
|
|
| MCULE-2653009262 |
0.74 |
CCCC(N1C(C(NCC2(C3=CC=CC=C3)CCN(C)CC2)=O)CCC1)=O
|
|
| MCULE-2033095464 |
0.74 |
CCC(C1C=CC(C)=CC=1)CC(N(C(C(=O)O)C)CCNC(=O)C)=O
|
|
| MCULE-1070619206 |
0.74 |
CC(C[C@@H](C(=O)O)NC(CNC(CCC1C=C(C)C=C(C)C=1)=O)=O)C
|
|
| MCULE-2974746481 |
0.74 |
CC(CC(C1=CC=CC=C1)CNC(C1NCCC1)=O)O
|
|
| MCULE-9219435814 |
0.74 |
CN1CCC(C2=CC=CC=C2)(CNC([C@H]2N(C(C)=O)CCC2)=O)CC1
|
|
| MCULE-4156114150 |
0.74 |
O=C([C@H](CC1C=CC=CC=1)NC(=O)[C@H](CO)N)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@@H](CC(=O)N)C(=O)O)CCCNC(=N)N)CC(C)C)CC(C)C
|
|
| MCULE-6317494904 |
0.74 |
[C@@H](NC(=O)[C@@H](N)CO)(C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](C(=O)O)CC(=O)N)CC1C=CC=CC=1
|
|
| MCULE-7435366401 |
0.74 |
COC(C1CC1)(CNC(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)C
|
|
| MCULE-7499365346 |
0.74 |
COCC(NC(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)CO
|
|
| MCULE-3272452625 |
0.74 |
OC1C2(CCC2)C(NC(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)C1
|
|
| MCULE-9454696361 |
0.74 |
CC1(C(O)CCCC1)CNC(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O
|
|
| MCULE-4100860950 |
0.74 |
CC(NC1CCN(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)CC1)=O
|
|
| MCULE-4755284988 |
0.74 |
CCC(N1CC(NC(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)CC1)=O
|
|
| MCULE-5202749198 |
0.74 |
CO[C@@H]1CN(C)[C@H](C(NCC2(N(C)C)CC3=C(C=CC=C3)C2)=O)C1
|
|
| MCULE-5545437788 |
0.74 |
CCCN1CCC(NC(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)CC1
|
|
| MCULE-3220356903 |
0.74 |
CO[C@@H]1CN(C)[C@H](C(NCC2(C3=CC=C(F)C=C3)CC2)=O)C1
|
|
| MCULE-3375608776 |
0.74 |
CO[C@@H]1CN(C)[C@H](C(NCC2(C3=C(C)C=CC=C3)CC2)=O)C1
|
|
| MCULE-8809228147 |
0.74 |
N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1C=CC(=CC=1)OC)C(CO)=O
|
|
| MCULE-4874666461 |
0.74 |
C(=O)(N[C@@H](CCC(O)=O)C(O)=O)C1(C2C=CC=CC=2)CCN(CC1)C(=O)[C@@H]1CCCN1.Cl
|
|
| MCULE-7208818647 |
0.74 |
O=C(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)CC1OCCC1
|
|
| MCULE-4496828267 |
0.74 |
O=C(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)CCC1OCCC1
|
|
| MCULE-6402117360 |
0.74 |
N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1=CC=C(C=C1)OC)C([C@@H](C)O)=O
|
|
| MCULE-8523929208 |
0.74 |
N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1=CC=C(C=C1)OC)C([C@H](C)O)=O
|
|
| MCULE-5224506361 |
0.74 |
CO[C@H]1C[C@@H](C(NCC2(C3=C(C)C=CC=C3)CC2)=O)NC1
|
|
| MCULE-3673887703 |
0.74 |
N1(C[C@@H](C[C@H]1C(O)=O)N(C)C)C(=O)CC(C1=CC=CC=C1)C1C=CC=CC=1
|
|
| MCULE-7529770922 |
0.74 |
N1(CCCCCC1=O)CC(=O)N[C@H]1CN(C[C@@H]1C1C=CC=CC=1)CCO
|
|
| MCULE-5463290594 |
0.74 |
C1(=O)N(CCCC1(CNCC(=O)N1CCNCC1)O)CCCC1=CC=CC=C1
|
|
| MCULE-1226207378 |
0.74 |
OC(=O)C(F)(F)F.C(N)(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC1C=CC(O)=CC=1)N
|
|
| MCULE-1304579765 |
0.74 |
OC([C@H]1C[C@@H](C(NC(C(N2CCCC2)=O)CC2C=CC=CC=2)=O)CC1)=O
|
|
| MCULE-5372542283 |
0.74 |
C1(=O)N(CCCC1(CNCC(=O)N1CCNCC1)O)CCC1C=CC=CC=1
|
|
| MCULE-6074054950 |
0.74 |
OC(CCNC(C(NC(C12CC3CC(C1)CC(C3)C2)=O)CC1C=CC=CC=1)=O)=O
|
|
| MCULE-8744360587 |
0.74 |
O=C(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)CC1CC2NC(CC2)C1
|
|
| MCULE-7849737122 |
0.74 |
OC1CC(C(N2CCC(CCC3C=CC=CC=3)CC2)=O)NC1
|
|
| MCULE-1753070590 |
0.74 |
N1[C@@H]([C@@H](C)CC)C(=O)N[C@H](CC2C=CC(=CC=2)O)C1=O
|
|
| MCULE-9404834999 |
0.74 |
OC(C1N(C(CNC(CC2C=CC=CC=2)=O)=O)CCC1)=O
|
|
| MCULE-1575087358 |
0.74 |
N1[C@@H](CC(C)C)C(=O)N[C@H](CC2C=CC(=CC=2)O)C1=O
|
|
| MCULE-6841080552 |
0.74 |
C1(CC2C=CC(O)=CC=2)C(=O)NC(CC(C)C)C(=O)N1
|
|
| MCULE-6942696122 |
0.74 |
N1(CCCNC(=O)[C@H](CC2=CC=CC=C2)NC(CN(C)C(=O)[C@H](C(C)C)NC(=O)[C@H]1C)=O)C(=O)[C@@H]1CCCN1
|
|
| MCULE-3713331176 |
0.74 |
OC([C@H]1N(C(CNC(CC2C=CC=CC=2)=O)=O)CCC1)=O
|
|
| MCULE-9657120166 |
0.74 |
CC(C1=CC=C(F)C=C1)CC(N1[C@@H](CO)CN2[C@@H](CCC2)C1)=O
|
|
| MCULE-2282626606 |
0.74 |
CN(CC1(CCN(C(C2N(C(CC3=CC=CC=C3)=O)CCC2)=O)CC1)O)C
|
|
| MCULE-8073167584 |
0.74 |
C(CC(=O)C)(=O)NC(C)C(=O)NC(CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-5893390596 |
0.74 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(CC1C=CC=CC=1)=O)C
|
|
| MCULE-9493018310 |
0.74 |
C(=O)(C(N)CC(O)=O)NC(CC1=CC=CC=C1)C(O)=O
|
|
| MCULE-9466107827 |
0.74 |
C1(=CC=CC=C1)C[C@@H](C(=O)O)NC(=O)[C@@H](N)CC(=O)O
|
|
| MCULE-8189547941 |
0.74 |
N1C(=O)C(CC2C=CC(O)=CC=2)NC(=O)C1C(CC)C
|
|
| MCULE-5453745833 |
0.74 |
CC(N(CC(NCC(C(=O)O)CC1C=CC=CC=1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-7216548850 |
0.74 |
CC1(C(=O)O)N(C(CNC(CC2C=CC=CC=2)=O)=O)CCC1
|
|
| MCULE-4197737012 |
0.74 |
OC([C@@H]1N(C(CNC(CC2C=CC=CC=2)=O)=O)CCC1)=O
|
|
| MCULE-4290681850 |
0.74 |
C1(=CC=CC=C1)C[C@@H](C(=O)O)NC(=O)[C@@H](N)CC(=O)O
|
|
| MCULE-3808715341 |
0.74 |
N12CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)OCC(=O)N[C@H](C(C)C)C2=O)C(=O)N1CCC(CC1)O
|
|
| MCULE-5618650722 |
0.74 |
[C@@H](NC([C@H](CO)NC(=O)[C@@H](N)CC(=O)O)=O)(C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N)CCSC)CC1C=CC=CC=1
|
|
| MCULE-1367015486 |
0.74 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)OCC(=O)N[C@H](CC1=CC=CC=C1)C2=O)C(=O)N1CCC(CC1)O
|
|
| MCULE-1329588245 |
0.74 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)OCC(=O)N[C@@H](C(C)C)C2=O)C(=O)N1CCC(CC1)O
|
|
| MCULE-8978352740 |
0.74 |
CC(C(N(C(C(=O)O)CC1C=CC=CC=1)C)=O)NC(C(C)(C)C)=O
|
|
| MCULE-4034778370 |
0.74 |
CC1CC(C(NC(C(N2CCN(C)CC2)=O)CC2=CC=CC=C2)=O)C1
|
|
| MCULE-2067068235 |
0.74 |
CC(C(NC(C(=O)O)CC1C=CC=CC=1)=O)NC(C(C)(C)C)=O
|
|
| MCULE-5715028826 |
0.74 |
C(=O)(NCC1(CCC1)CO)[C@H](CC1C=CC=CC=1)N(C)C
|
|
| MCULE-4172034200 |
0.74 |
CC1=CC(CCC(N2C(C(NC3CC3)=O)CCC2)=O)=CC=C1
|
|
| MCULE-8999995999 |
0.74 |
CCN1CCN(C(C(NC(C2CCC2)=O)CC2=CC=CC=C2)=O)CC1
|
|
| MCULE-7364520243 |
0.74 |
CCC(C1C=CC=CC=1)CC(NC(C(=O)O)CC1C=CC=CC=1)=O
|
|
| MCULE-3390598814 |
0.74 |
OC1CN(CC(NCC2(C3=CC=CC=C3)CC2)=O)CCC1
|
|
| MCULE-5933641520 |
0.74 |
CO[C@@H]1CN(C(CC2=CC(C3CC3)=CC=C2)=O)[C@H](C(N)=O)C1
|
|
| MCULE-4347801128 |
0.74 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)NCCN(C(=O)[C@@H]2CCCO2)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-8028290272 |
0.74 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)NCCN(C(=O)[C@H]2CCCO2)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-6788993588 |
0.74 |
N1(C[C@H](CC)NC(=O)[C@H](CC2=CC=CC=C2)NC([C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C1)=O)C(=O)[C@H]1CCCO1
|
|
| MCULE-2601274361 |
0.74 |
CC1(C(NC(C(=O)O)CC2C=CC=CC=2)=O)N(C(C2C=CC=CC=2)=O)CCC1
|
|
| MCULE-6704868233 |
0.74 |
N1(C[C@H](CC)NC(=O)[C@H](CC2=CC=CC=C2)NC([C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C1)=O)C(=O)[C@@H]1CCCO1
|
|
| MCULE-3384760249 |
0.74 |
CO[C@@H]1CN(C(CCC2=C(C)C=C(C)C=C2)=O)[C@H](C(N)=O)C1
|
|
| MCULE-7440231126 |
0.74 |
CO[C@@H]1CN(C(CCC2=CC=C(C#N)C=C2)=O)[C@H](C(N)=O)C1
|
|
| MCULE-9019452674 |
0.74 |
N1(C[C@H]([C@H](C(O)=O)C1)C1C=CC=CC=1)C(=O)C1CCCN(CC(N)=O)C1
|
|
| MCULE-9132604761 |
0.74 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)CC1C=CC=CC=1
|
|
| MCULE-7322769153 |
0.74 |
N1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C(C)C)NC(CN(C(=O)CCC2C=CC=CC=2Cl)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-3153423390 |
0.74 |
CO[C@@H]1CN(C(CC2=CC3=C(C=CC=C3)C=C2)=O)[C@H](C(N)=O)C1
|
|
| MCULE-1480667737 |
0.74 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(=O)CC1C=CC(=CC=1)Cl
|
|
| MCULE-1863480477 |
0.74 |
OC(C(NC(C1N(CC2C=CC=CC=2)CCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-5447779262 |
0.74 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(CC2C=CC=CC=2)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-3158670476 |
0.74 |
N1(C[C@H]([C@H](C(O)=O)C1)C1C=CC=CC=1)C(=O)C1(CCCCC1)N1CCCC1
|
|
| MCULE-6084244582 |
0.74 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(CCNC(=O)[C@@H]1[C@@H](C)O)C(=O)CC1C(C)=CC(=CC=1C)C)=O
|
|
| MCULE-7657612195 |
0.74 |
CC(NC(C1(N(C)CC(O)C1)C)=O)CC1=C(Cl)C=CC=C1Cl
|
|
| MCULE-3345095278 |
0.74 |
N1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C(C)C)NC(CN(C(=O)CC2C=CC(=CC=2)C(F)(F)F)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-9935180735 |
0.74 |
CO[C@@H]1CN(C(CC2=C3C(C=CC=C3)=CC=C2)=O)[C@H](C(N)=O)C1
|
|
| MCULE-2566111369 |
0.74 |
C1(=O)[C@@H]2CCCN2C(=O)CN(C[C@H]2OCC[C@@H]([C@@H]2O)NC(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@H](C)N1C)C(=O)CC(C)C
|
|
| MCULE-8370769824 |
0.74 |
N12CCC[C@@H]1C(=O)N[C@H](CC(C)C)C(=O)N[C@H]1CCO[C@@H]([C@H]1O)CN(C(=O)CC(C)C)CC(=O)N[C@@H](CC1C=CC=CC=1)C2=O
|
|
| MCULE-9176513941 |
0.74 |
C1(=O)[C@@H]2CCCN2C(=O)CN(C[C@H]2OCC[C@@H]([C@@H]2O)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](C)N1C)C(C)=O
|
|
| MCULE-6132303435 |
0.74 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC(C1CCOCC1)=O
|
|
| MCULE-1673628619 |
0.74 |
C(F)(F)(F)C1=CC=CC(CCNC(=O)[C@H]2C[C@H](CN2)O)=C1
|
|
| MCULE-3384870639 |
0.74 |
OC1C(=O)N(CC(NC2(CC2)CC2=CC=CC=C2)=O)CCCC1
|
|
| MCULE-1216960302 |
0.74 |
CN1C(C(NCC(C2=CC(Cl)=CC=C2)(C)C)=O)(C)CC(O)C1
|
|
| MCULE-2994720002 |
0.74 |
CO[C@H]1C[C@@H](C(N(CCC2=C3C(C=CC=C3)=CC=C2)C)=O)NC1
|
|
| MCULE-1877604924 |
0.74 |
OC1CC(C(NCCC2=CC(Cl)=CC=C2)=O)NC1.Cl
|
|
| MCULE-5711054850 |
0.74 |
N1(CCNC(=O)C1CC1C=CC=CC=1)C(C1CCOCC1)=O
|
|
| MCULE-6655372462 |
0.74 |
OC1CC(C(NCCC2=CC(Cl)=CC=C2)=O)NC1
|
|
| MCULE-6916657603 |
0.74 |
OC1(C2=CC=CC=C2)CN(C(CN2CC(=O)NCC2)=O)CCC1
|
|
| MCULE-3138726352 |
0.74 |
OC[C@@H]1N(C(CCC2=CC(Cl)=CC=C2)=O)C[C@H]2N(CCC2)C1
|
|
| MCULE-6191816117 |
0.74 |
CC(C1=CC(Br)=CC=C1)(CNC([C@@H]1NC[C@@H](O)C1)=O)C
|
|
| MCULE-5339199039 |
0.74 |
CO[C@@H]1CN(C)[C@H](C(NCCC2=CC3=C(C=CC=C3)C=C2)=O)C1
|
|
| MCULE-3343235770 |
0.74 |
CC1=C(O)C(C)=CC(CCNC([C@@H]2NC[C@H](O)C2)=O)=C1
|
|
| MCULE-8276799095 |
0.74 |
CCC(C1=CC=CC=C1)CC(N1C(C(N2CCOCC2)=O)CCC1)=O
|
|
| MCULE-8680715574 |
0.74 |
C[C@@H](N)C(N1[C@@H](CCC1)C(N[C@@H](CO)C(NCC(N[C@H](C(N[C@@H](CCC(N)=O)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CC(C)C)C(N[C@@H](C(NCC(N[C@@H](C(NCC(N[C@@H](CC(C)C)C(N)=O)=O)=O)CC1C=CC=CC=1)=O)=O)CC1C=CC(O)=CC=1)=O)=O)=O)=O)C)=O)=O)=O)=O
|
|
| MCULE-7170612227 |
0.74 |
CC(C1CNCCC1)CC(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-3517214910 |
0.74 |
CC(C(C(NC(C(=O)O)CC1C=CC=CC=1)=O)NC(CC1C=CC=CC=1)=O)C
|
|
| MCULE-8377951427 |
0.74 |
Cl.OC1CC(C(N2CCC(CC3C=CC=CC=3)CC2)=O)NC1
|
|
| MCULE-8020483357 |
0.74 |
CC(NC(C1N(C(C)=O)CCC1)=O)CC(C1=CC=CC=C1)O
|
|
| MCULE-8624593079 |
0.74 |
CC(C(C(N1CC(CC2=CC=CC=C2)CC1)=O)NC(C1CC1)=O)O
|
|
| MCULE-4911110438 |
0.74 |
O=C(C1C2(CCNCC2)C1)NC(C(N1CCCC1)=O)CC1C=CC=CC=1
|
|
| MCULE-4821296032 |
0.74 |
NC1C2CC(C(NC(C(N3CCCC3)=O)CC3C=CC=CC=3)=O)CC1CCC2
|
|
| MCULE-3472344026 |
0.74 |
CC(C(N1[C@@H](CO)CN2[C@@H](CCC2)C1)=O)CC1=C(C)C=CC=C1
|
|
| MCULE-1126605840 |
0.74 |
CCCCC(NC(C(N1CCN(C)CC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-4707171894 |
0.74 |
C1(C)(C)C(C1(C)C)C(=O)N1C[C@H](CC2C=CC=CC=2)NC(=O)C1
|
|
| MCULE-5688075824 |
0.74 |
CCN(C(CC1=CC=CC=C1)CNC(C1N(C(CC(C)(C)C)=O)CCC1)=O)CC
|
|
| MCULE-1360335539 |
0.74 |
N1(C[C@H](CC2C=CC=CC=2)NC(=O)C1)C(=O)[C@H](CC(C)C)NC(C)=O
|
|
| MCULE-7410503058 |
0.74 |
N1(C(CCC2C=C(C)C=C(C)C=2)=O)C[C@@H]2CCCN2C(=O)[C@H]1C
|
|
| MolPort-019-939-039 |
0.74 |
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CC[C@@H](C)[C@H](NC(=O)[C@@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@H](CC(N)=O)C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CCCCN)C(=O)NCC(=O)N1CCC[C@@H]1C(=O)N[C@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@H](CCCNC(N)=N)C(N)=O
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| MolPort-027-817-664 |
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C[C@@H]1CN(C[C@@]1(O)C1CC1)C(=O)CN1CCC(CC1)C1=CC=CC=C1
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| MolPort-009-116-725 |
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O=C(NC(CC1=CC=CC=C1)C(=O)N1CCCC1)C1CCCC1
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| MolPort-046-684-359 |
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COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCC1=CC=CC=C1)NC(=O)CN1CCOCC1
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| MolPort-045-993-379 |
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CCC(CC#N)NC(=O)C1CC(O)CN1C(=O)CC1=CC=CC=C1F
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| MolPort-045-993-380 |
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CC(CN(C)C(=O)C1CC(O)CN1C(=O)CC1=CC=CC=C1F)C#N
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| MolPort-045-933-970 |
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C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCC2=CC=CC=C2)NC(=O)COC2=CC=C(C[C@H](NC1=O)C(=O)N1CCC(O)(CO)CC1)C=C2
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| MolPort-046-094-485 |
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CC1(C)CN(CCN1CCO)C(=O)C1CCCN1C(=O)CC1=CC=CC=C1
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| MolPort-039-161-635 |
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Cl.CO[C@@H]1CN[C@@H](C1)C(=O)NCC1(CC1)C1=CC=CC=C1C
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| MolPort-046-567-067 |
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COC1=CC=C(C[C@@H]2NC(=O)[C@H](CC(C)C)NC(=O)CN(CC(O)=O)C[C@@H](NC(=O)[C@@H](C)NC2=O)C(C)C)C=C1
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| MolPort-016-636-120 |
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OC(=O)C(CC1=CC=CC=C1)N1C(=O)NC(CC2=CC=CC=C2)C1=O
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| MolPort-039-160-454 |
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CO[C@H]1C[C@H](N(C)C1)C(=O)NCC1(CCOCC1)C1=CC=CC=C1
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| MolPort-044-488-531 |
0.73 |
CC(=O)N1C[C@H](O)C[C@@H]1C(=O)NC1(CCC1)C1=CC=CC=C1
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OC[C@H](NC(=O)C[C@@H](CNC(=O)[C@@H]1CCCN1)C1=CC=C(Cl)C=C1)C(O)=O
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Cl.OC[C@H](NC(=O)C[C@@H](CNC(=O)[C@@H]1CCCN1)C1=CC=C(Cl)C=C1)C(O)=O
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| MolPort-045-934-116 |
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COC1CCN(CC1)C(=O)[C@@H]1CC2=CC=C(OCC(=O)N[C@H](CC3=CC=CC=C3)C(=O)N3CCC[C@@H]3C(=O)N[C@@H](C)C(=O)N1)C=C2
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| MolPort-009-123-213 |
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CCC(CNC(=O)C1CCCN1C(C)=O)C1=CC=CC=C1
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CC(=O)N1CCCCC1C(=O)NC(CO)CC1=CC=C(F)C=C1
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| MolPort-045-935-429 |
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| MolPort-019-939-194 |
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C[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@@H](O)[C@H](N)CC1=CC=CC=C1)C(N)=O
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| MolPort-028-609-467 |
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CNC(=O)[C@@H](CC1=CC=CC=C1)N1CCC[C@H]1C(=O)N1CCOCC1
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CC(=O)N(CCC1=CC=CC=C1)CC(=O)N1CCC(C)(O)C1
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| MolPort-013-172-894 |
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O=C([C@@H]1CCCN1)N1CCC(C1)C1=CC=CC=C1
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| MolPort-046-737-875 |
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CC(C)(CC(=O)N1C[C@H](CC2=CC=CC=C2)NC(=O)C1)C1=CC=CC=C1
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| MolPort-009-542-795 |
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CC(C)C(CNC(=O)C1CCCN1C(C)=O)C1=CC=CC=C1
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| MolPort-045-934-373 |
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COC1CCN(CC1)C(=O)[C@@H]1CC2=CC=C(OCC(=O)N[C@@H](C(C)C)C(=O)N3CCC[C@@H]3C(=O)N[C@@H](C)C(=O)N1)C=C2
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| MolPort-046-418-703 |
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CC[C@H](C)[C@H](NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H](N)CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(O)=O
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CC(C)[C@@H]1N(C)C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CC(O)=O)NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC1=O
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|
| MCULE-2802472294 |
0.73 |
CC(N1[C@@H](C(NC2(C3=CC=CC=C3)CCC2)=O)C[C@@H](O)C1)=O
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|
| MCULE-9005927457 |
0.73 |
O=C(N1CC(C2=CC=CC=C2)CC1)[C@H]1NCCC1
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|
| MCULE-6009598954 |
0.73 |
CC1N(C(C2NCCC2)=O)CCC1C1C=CC=CC=1
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| MCULE-6796144608 |
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CCC(C1=CC=CC=C1)CNC(C1N(C(C)=O)CCC1)=O
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|
| MCULE-9807239153 |
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O=C(N1CC(C2C=CC=CC=2)CC1)C1NCCC1
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| MCULE-6874345438 |
0.73 |
N1(C[C@H](CC2C=CC=CC=2)NC(=O)C1)C(=O)CC(C)(C)C1=CC=CC=C1
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|
| MCULE-9911006180 |
0.73 |
CC(N(CC(N1CC(O)(C)CC1)=O)CCC1=CC=CC=C1)=O
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|
| MCULE-2170384901 |
0.73 |
CC(C(C1=CC=CC=C1)CNC(C1N(C(C)=O)CCC1)=O)C
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|
| MCULE-2812807777 |
0.73 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)OCC(=O)N[C@H](CC1=CC=CC=C1)C2=O)C(=O)N1CCC(CC1)OC
|
|
| MCULE-9534996101 |
0.73 |
N12CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)OCC(=O)N[C@H](C(C)C)C2=O)C(=O)N1CCC(CC1)OC
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|
| MCULE-4050290085 |
0.73 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)OCC(=O)N[C@@H](C(C)C)C2=O)C(=O)N1CCC(CC1)OC
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| MCULE-7191486908 |
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CCCC(N1C(C(NCC(C2C=CC=CC=2)(C(=O)O)CC)=O)CCC1)=O
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|
| MCULE-7512966173 |
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CC(N1C(C(NC(CC2=CC=C(F)C=C2)CO)=O)CCCC1)=O
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|
| MCULE-3250496116 |
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OC(C1CC(C(NC(C(N2CCCC2)=O)CC2=CC=CC=C2)=O)CCC1)=O
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|
| MCULE-6124793080 |
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OC(C1CC1)CC(N1C(CC2=CC=CC=C2)C(=O)NCCC1)=O
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|
| MCULE-8488751327 |
0.73 |
CCC(C1C=CC=CC=1)(C(=O)O)CNC(C1N(C(CC(C)(C)C)=O)CCC1)=O
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|
| MCULE-1974982453 |
0.73 |
C1CN(C(=O)[C@H]2N(C(=O)[C@@H](O)[C@@H](CC3C=CC=CC=3)N)CCC2)[C@H](C(=O)N[C@H](C(N)=O)C)C1
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| MCULE-8652681219 |
0.73 |
O=C1[C@@H](CC2C=CC=CC=2)NC([C@H](CC(O)=O)NC(CNC([C@H](CCCNC(N)=N)NC([C@H](C(C)C)N1C)=O)=O)=O)=O
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|
| MCULE-1048276799 |
0.73 |
C([C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N1)C1C=CC=CC=1
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|
| MCULE-4365255542 |
0.73 |
C([C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC([C@@H](N)CCCNC(N)=N)=O)(=O)N[C@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)N[C@H](C(=O)O)CC(C)C)CC1C=CC(O)=CC=1
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| MCULE-4146875750 |
0.73 |
O=C(C[C@@H]1NC(=O)CNC(=O)[C@H](CCC/N=C(\N)/N)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@@H](CC2C=CC=CC=2)NC1=O)O.O=C(C(F)(F)F)O
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| MCULE-2258268717 |
0.73 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(=O)C1C=CC3=C(C=CC=N3)C=1)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
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| MCULE-4783195435 |
0.73 |
N12C[C@@H](C[C@H]1C(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)COC1=CC=C(C=C1)C[C@@H](C(=O)N[C@@H](CC)C2=O)NC(C1CCOCC1)=O)O
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|
| MCULE-6106355161 |
0.73 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(CC1C=CC=NC=1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
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| MCULE-2027512334 |
0.73 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(CC1C=CC=C(OC)C=1OC)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
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|
| MCULE-1831982418 |
0.73 |
CN1C(C(N2CCC(C(C3=CC=CC=C3)O)CC2)=O)(C)CC(O)C1
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| MCULE-6233254899 |
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OC(C1N(C(CNC(CC2C=CC=C3C=2C=CC=C3)=O)=O)CCC1)=O
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|
| MCULE-9423136348 |
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CC1C=CC(CCC(NCC(NC(C(=O)O)CCC(C)(C)C)=O)=O)=CC=1
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|
| MCULE-3157945568 |
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CCCCC(C(O)=O)NC(CNC(CCC1=CC=C(C)C=C1)=O)=O
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|
| MCULE-7262712844 |
0.73 |
N1[C@@H](C2CC2)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C1=O
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|
| MCULE-4375072203 |
0.73 |
N1[C@@H](C2CC2)C(=O)N[C@H](CC2C=CC(=CC=2)O)C1=O
|
|
| MCULE-3290867860 |
0.73 |
CC(C[C@@H](C(=O)O)NC(CNC(C1(CCC1)CC1C=CC=CC=1)=O)=O)C
|
|
| MCULE-4101317622 |
0.73 |
CN1C(C(NCC2CCC(C3=CC=CC=C3)CC2)=O)(C)CC(O)C1
|
|
| MCULE-7628237501 |
0.73 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(C1CCCC1)=O)C
|
|
| MCULE-7545935894 |
0.73 |
CC(N(CC(NCC(C(=O)O)CC1C=CC=C(C)C=1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-4865994239 |
0.73 |
C(=O)([C@@H]1CCCN1CC)N[C@H](C)C(O)(C1C=CC=CC=1)C1C=CC=CC=1
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|
| MCULE-3743907978 |
0.73 |
N1(CC(O)CN(CCC2C=CC=CC=2)C(=O)C1)C(=O)CC1CCN(CC1)C(C)=O
|
|
| MCULE-8766845459 |
0.73 |
OC1CCN(C(C2C(C3=CC=CC=C3)CCCN2)=O)CC1
|
|
| MCULE-5899615986 |
0.73 |
CC1(C(=O)O)N(C(CNC(CC2C=CC=C3C=2C=CC=C3)=O)=O)CCC1
|
|
| MCULE-7434653838 |
0.73 |
C1C=C(C[C@H](N)C(=O)N[C@H](C)C(=O)NCC(=O)N(C)[C@H](C(=O)NCCO)CC2C=CC=CC=2)C=CC=1O
|
|
| MCULE-6328649638 |
0.73 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(CCC1CCN(CC1)C)=O)C
|
|
| MCULE-9339238137 |
0.73 |
OC([C@H]1N(C(CNC(CC2C=CC=C3C=2C=CC=C3)=O)=O)CCC1)=O
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|
| MCULE-6342913223 |
0.73 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(=O)CC(C1=CC=CC=C1)C1=CC=CC=C1)C
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|
| MCULE-2056734559 |
0.73 |
C(NC(=O)C)(C(=O)NC(C)C(=O)OC)CC1=CC=CC=C1
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|
| MCULE-7027738318 |
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Cl.OC1CC(C(N2CCC(CCC3C=CC=CC=3)CC2)=O)NC1
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|
| MCULE-3388652531 |
0.73 |
COCC(C(NC(C(NC1CC1)=O)CC1C=CC=CC=1)=O)N
|
|
| MCULE-8420057239 |
0.73 |
OC([C@@H]1N(C(CNC(CC2C=CC=C3C=2C=CC=C3)=O)=O)CCC1)=O
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|
| MCULE-4311039160 |
0.73 |
C(O)[C@H](C(N[C@@H](CCC(N)=O)C(N[C@@H](C(N[C@H](C(N[C@H](CC(C)C)C(N[C@@H](C(N[C@H](CCC(N)=O)C(N1[C@@H](CCC1)C(N[C@@H](CCC(N)=O)C(N[C@@H](CCCNC(N)=N)C(N[C@H](C(N)=O)CC1C=CC=CC=1)=O)=O)=O)=O)=O)CC1C=CC=CC=1)=O)=O)CC1C=CC=CC=1)=O)C)=O)=O)N
|
|
| MCULE-5235763488 |
0.73 |
C1(=O)[C@@H]2CCCN2C(=O)CN(C[C@H]2OCC[C@@H]([C@@H]2O)NC(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@H](C)N1C)C(=O)CN1CCCCC1=O
|
|
| MCULE-9540529781 |
0.73 |
N12CCC[C@@H]1C(=O)N[C@H](CC(C)C)C(=O)N[C@H]1CCO[C@@H]([C@H]1O)CN(C(=O)C1CC1)CC(=O)N[C@@H](CC1=CC=CC=C1)C2=O
|
|
| MCULE-6610112647 |
0.73 |
C1(=O)[C@@H]2CCCN2C(=O)CN(C[C@H]2OCC[C@@H]([C@@H]2O)NC(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@H](C)N1C)C(C1CCC1)=O
|
|
| MCULE-4644574077 |
0.73 |
CNC([C@H](N1[C@H](C(NCC2CC2)=O)CCC1)CC1C=CC=CC=1)=O
|
|
| MCULE-1855269567 |
0.73 |
CC(C(CC1=CC=CC=C1)(CNC(C1N(C)CCC1)=O)C)O
|
|
| MCULE-2257037140 |
0.73 |
COCCCNC(CN(C(C(N(C)C)CC1=CC=CC=C1)=O)C)=O
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|
| MCULE-2053460677 |
0.73 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2C=CC=CC=2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(=O)CC1C=C(C)C=CC=1C
|
|
| MCULE-3463118461 |
0.73 |
[C@@H](NC(=O)[C@@H](C)NC(=O)[C@@H](N)CC1C=CC(O)=CC=1)(C(=O)N[C@@H](CCC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N)CC1C=CC=CC=1
|
|
| MCULE-6267319913 |
0.73 |
N1(C[C@H](CC2C=CC=CC=2)NC(=O)C1)C(=O)C1(CCCCC1)N1CCOCC1
|
|
| MCULE-4412327171 |
0.73 |
CO[C@@H]1CN(C(CC2=CC=C(C(C)(C)C)C=C2)=O)[C@H](C(N)=O)C1
|
|
| MCULE-7499132078 |
0.73 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@H](CC1C=CC=CC=1)C2=O)C(=O)N1CCC(CC1)CO
|
|
| MCULE-8538676042 |
0.73 |
N1(CC[C@@H](O)C1)C(=O)[C@@H]1CC2C=CC(=CC=2)OCC(N[C@@H](CC(C)C)C(=O)N(CCOC)CC(=O)N1)=O
|
|
| MCULE-1441186534 |
0.73 |
N1(CC[C@@H](O)C1)C(=O)[C@H]1CC2C=CC(=CC=2)OCC(N[C@@H](CC(C)C)C(=O)N(CCOC)CC(=O)N1)=O
|
|
| MCULE-9806092671 |
0.73 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(CC1=CC=C(C=C1)S(C)(=O)=O)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
|
|
| MCULE-9698446388 |
0.73 |
N12C[C@@H](CC1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)=O)NC(COC)=O
|
|
| MCULE-8445740451 |
0.73 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC(=O)C1(CCC1)C1=CC=C(C=C1)Cl
|
|
| MCULE-9801384287 |
0.73 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@@H](C(C)C)C2=O)C(=O)N1CCC(CC1)CO
|
|
| MCULE-7151804335 |
0.73 |
N1(C[C@@H](C[C@H]1C(NC)=O)O)C1CCN(CC1)C(CCCC1C=CC=CC=1)=O
|
|
| MCULE-1096776233 |
0.73 |
C(=O)([C@]([H])(NC)CC(C)C)N[C@]([H])(CC1C=CC=CC=1)C(OC)=O
|
|
| MCULE-1331090784 |
0.73 |
CN1C(C(NCCC2=C(Cl)C=CC=C2)=O)(C)CC(O)C1
|
|
| MCULE-8965352527 |
0.73 |
CN1C(C(NCC(C2=C(Cl)C=CC=C2)(C)C)=O)(C)CC(O)C1
|
|
| MCULE-5229134673 |
0.73 |
CCC(NC(C(N1C(C(C2=CC=CC=C2)O)CCC1)=O)C)=O
|
|
| MCULE-9362650208 |
0.73 |
N12C[C@@H](C[C@H]1C(=O)N[C@H](CC1=CC=CC=C1)C2=O)N(C)C
|
|
| MCULE-6971865396 |
0.73 |
OC1CC(C(NCCC2=C(Cl)C=CC=C2)=O)NC1
|
|
| MCULE-9774674122 |
0.73 |
CC(C(N1C(C(C2=CC=CC=C2)O)CCC1)=O)NC(C(C)(C)C)=O
|
|
| MCULE-3792915382 |
0.73 |
Cl.OC1CC(C(NCCC2=C(Cl)C=CC=C2)=O)NC1
|
|
| MCULE-8811593044 |
0.73 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)N(C)C
|
|
| MCULE-8604755334 |
0.73 |
CC1=CC=C(CCC(NCC(NC(C(O)=O)CC2=CC=C(F)C=C2)=O)=O)C=C1
|
|
| MCULE-6578012434 |
0.73 |
N1(CCCC1C(O)=O)C(=O)C(CCCCN)NC(CCC1C=CC=CC=1)C(O)=O
|
|
| MCULE-4438189883 |
0.73 |
CO[C@H]1C[C@@H](C(N(CCC2=C3C(C=CC=C3)=CC=C2)C)=O)NC1.Cl
|
|
| MCULE-2008397128 |
0.73 |
C(N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N)CC1C=CC=CC=1)(=O)[C@@H](NC([C@@H](N)C)=O)CC1C=CC(O)=CC=1
|
|
| MCULE-6087134417 |
0.73 |
O=C([C@H](CC1=CC=C(C=C1)O)NC(CN)=O)N1CCC[C@H]1C(NCC(N[C@H](C(N[C@H](C(N)=O)CC1=CC=CC=C1)=O)CCCCN)=O)=O
|
|
| MCULE-7813362088 |
0.73 |
N1(CCC[C@H]1C(O)=O)C(=O)[C@H](CCCCN)N[C@@H](CCC1C=CC=CC=1)C(O)=O
|
|
| MCULE-1557804592 |
0.73 |
N1(CC[C@]([C@H](N2CCCC2)C1)(O)C1=CC=CC=C1)C(C1CCCC1)=O
|
|
| MCULE-6212648343 |
0.73 |
C(CNC(CC(C(C)C)Br)=O)(NC(CC1C=CC=CC=1)C(O)=O)=O
|
|
| MCULE-5869146518 |
0.73 |
N1(CCC[C@H]1C(O)=O)C(=O)[C@H](CCCCN)N[C@@H](CCC1C=CC=CC=1)C(O)=O
|
|
| MCULE-1143905329 |
0.73 |
C[C@@H](N)C(N[C@@H](C(N1[C@@H](CCC1)C(NCC(N[C@@H](CCCCN)C(N[C@@H](C(N)=O)CC1C=CC=CC=1)=O)=O)=O)=O)CC1C=CC(O)=CC=1)=O
|
|
| MCULE-6068644603 |
0.73 |
OC1CC(C(NCCC2C(F)=CC=CC=2F)=O)NC1
|
|
| MCULE-2988931986 |
0.73 |
[C@H]1(CN(C[C@H]1C1C=CC=CC=1)CC(=O)N(C)C1CCCCC1)C(O)=O
|
|
| MCULE-9914386174 |
0.73 |
C1C2C(CC1N1CC3(C(N(CCCN4C(=O)CCC4)C(=O)[C@H]4N3C[C@@H](C4)O)=O)C1)=CC=CC=2
|
|
| MCULE-7656871299 |
0.73 |
CSCC[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1NC(=O)CC1)CO)CCCCN)CC(=O)O)C)CC1C=CC=CC=1)[C@H](CC)C)CC(C)C)C(=O)N.CC(=O)O
|
|
| MCULE-9787196513 |
0.73 |
CSCC[C@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@H]1NC(=O)CC1)CO)CCCCN)CC(=O)O)C)CC1C=CC=CC=1)[C@H](CC)C)CC(C)C)C(=O)N
|
|
| MCULE-1671829536 |
0.73 |
OC(C1=CC2=C(C=CC=C2)C=C1)CNC(C1NC(=O)CC1)=O
|
|
| MCULE-9355609669 |
0.73 |
N12CCC[C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CN(C(CCCN1CCCCC1=O)=O)CC(=O)N[C@@H](C)C2=O)CC1C=CC=CC=1
|
|
| MCULE-5184354735 |
0.73 |
OC(C(NC(C(N1CCOCC1)=O)CC1=CC=CC=C1)=O)C1CCCCC1
|
|
| MCULE-8388246267 |
0.73 |
C(=O)(NC1(CCCCC1)CO)[C@H](CC1C=CC=CC=1)N(C)C
|
|
| MCULE-2522681911 |
0.73 |
[C@@]1(O)(C2=CC=CC=C2)CCN(C[C@H]1N(C)C)C(CCC1=CC=CC=C1)=O
|
|
| MCULE-5355290745 |
0.73 |
C(=O)(NC1(CCCCCC1)CO)[C@H](CC1C=CC=CC=1)N(C)C
|
|
| MCULE-6883425845 |
0.73 |
OCC1CN(C(C2N(C(CC3=CC=CC=C3)=O)CCC2)=O)CCC1
|
|
| MCULE-3815443981 |
0.73 |
N1(C)C[C@H](C[C@H]1C(O)=O)NC(=O)[C@@H](N)CC1=CC=C(C=C1)O
|
|
| MCULE-2547376107 |
0.73 |
CC(C(=O)O)N(C(CC(C1C=CC=CC=1)CC1C=CC=CC=1)=O)CCNC(=O)C
|
|
| MCULE-9607859772 |
0.73 |
N12CCC[C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CN(C(=O)CN1CCC(CC1)C(N)=O)CC(=O)N[C@@H](C)C2=O)CC1C=CC=CC=1
|
|
| MCULE-2014980671 |
0.73 |
N12CCC[C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CN(C(=O)C1CCN(CC1)C(C)=O)CC(=O)N[C@@H](C)C2=O)CC1=CC=CC=C1
|
|
| MCULE-1484850441 |
0.73 |
N1(C[C@@H]([C@@H](N2CCCCC2)C1)O)C(=O)CC(C)(C)C1C=CC=CC=1
|
|
| MCULE-7702418768 |
0.73 |
N12C[C@@H](C[C@H]1C(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-7642558632 |
0.73 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-9121262076 |
0.73 |
N12C[C@@H](C[C@@H]1C(=O)N[C@@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-8790141986 |
0.73 |
CO[C@@H]1CN(C([C@@H]2[C@@H](C3=CC=CC=C3)C2)=O)[C@H](CN2CCCC2)C1
|
|
| MCULE-1710213698 |
0.73 |
C1(CC2C(=CC=CC=2)C1)(N1CCN(CC1)CC)C(=O)N1CCC[C@H]1CO
|
|
| MCULE-2480021924 |
0.73 |
C(=O)(N[C@@H](CCC(N)=O)C(O)=O)C1(C2C=CC=CC=2)CCN(CC1)C(=O)[C@@H]1CCCN1
|
|
| MCULE-6662530952 |
0.73 |
[C@H](C(=O)O)(NC([C@@H](N)C(C)C)=O)CC1C=CC=CC=1
|
|
| MCULE-7514297917 |
0.73 |
CC(C[C@H](C(=O)O)NC(CN(C(=O)C)CCC1C=CC=CC=1)=O)C
|
|
| MCULE-9549451588 |
0.73 |
CC(C[C@@H](C(=O)O)NC(CN(C(=O)C)CCC1C=CC=CC=1)=O)C
|
|
| MCULE-4070554442 |
0.73 |
CC(C(C(NC(C(O)=O)CC1=CC=CC=C1)=O)N)C
|
|
| MCULE-2523079664 |
0.73 |
CCCC(C(O)=O)(NC(CN(C(C)=O)CCC1=CC=CC=C1)=O)C
|
|
| MCULE-4387553441 |
0.73 |
CCCC(C(=O)O)NC(CN(C(=O)C)CCC1C=CC=CC=1)=O
|
|
| MCULE-5352679881 |
0.73 |
CC[C@@H]([C@@H](C(=O)O)NC(CN(C(=O)C)CCC1C=CC=CC=1)=O)C
|
|
| MCULE-1646000122 |
0.73 |
CN1[C@@H]2[C@@H](CN(C(C3N(C(CC4=C(F)C=CC=C4)=O)CC(O)C3)=O)C2)CC1
|
|
| MCULE-2900764385 |
0.73 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(N2CCOCC2)=O)C1
|
|
| MCULE-5276725798 |
0.73 |
CN(C(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)CC(C)=C
|
|
| MCULE-6807196660 |
0.73 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(N2CC(C#N)C2)=O)C1
|
|
| MCULE-7664198690 |
0.73 |
CCOC1CN(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)C1
|
|
| MCULE-3042239683 |
0.73 |
CC(NC(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)CC=C
|
|
| MCULE-5339766170 |
0.73 |
CN(C(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)CCN1CCOCC1
|
|
| MCULE-1013187918 |
0.73 |
C[C@@H]1O[C@H](C)CN(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)C1
|
|
| MCULE-4416966464 |
0.73 |
N1[C@H](CC2C=CC(=CC=2)O)C(=O)N[C@@H](CCCCN)C1=O
|
|
| MCULE-2706772352 |
0.73 |
CC1C=CC(CCC(NCC(N2[C@@H](C(=O)O)CCCC2)=O)=O)=CC=1
|
|
| MCULE-5578515273 |
0.73 |
CCC(NC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O)COC
|
|
| MCULE-5102356096 |
0.73 |
CC1C=CC(CCC(NCC(N2C(C(=O)O)CCCC2)=O)=O)=CC=1
|
|
| MCULE-2097692086 |
0.73 |
N1(CCCCC1=O)CC(=O)N[C@H](COC)CC1C=CC=CC=1
|
|
| MCULE-4358993038 |
0.73 |
[Cl-].N1(CCC[C@H]1C(O)=O)C(=O)[C@H]1CC[C@@H](CC1)CNC(=O)[C@H](CC1=CC=CC=C1)[NH3+]
|
|
| MCULE-2681454314 |
0.73 |
CC1CC(C(=O)O)N(C(CNC(CCC2C=CC(C)=CC=2)=O)=O)CC1
|
|
| MCULE-1499970540 |
0.73 |
C(CC1C=CC=CC=1)(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(O)=O
|
|
| MCULE-8446768836 |
0.73 |
CCCC(C(=O)O)NC(C(NC(CC1C=CC=CC=1)=O)CCC)=O
|
|
| MCULE-1670379915 |
0.73 |
CCCC(C(N[C@@H](C(=O)O)CC(C)C)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-6572639536 |
0.73 |
CC(C[C@@H](C(NCCO)=O)NC([C@@H]1[C@@H](C2=CC=CC=C2)C1)=O)C
|
|
| MCULE-1981561161 |
0.73 |
OCC1(CCC1)CNC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O
|
|
| MCULE-4455101848 |
0.73 |
CN(C(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)C1C(=O)N(C)CC1
|
|
| MCULE-8889711951 |
0.73 |
N1(CCCC1C(O)=O)C(=O)C(CC1=CC=C(C)C=C1)NC(C1C=CC=CC=1)=O
|
|
| MCULE-4828190755 |
0.73 |
C(C(O)=O)(C(C)C)NC(=O)C(N)CC1C=CC=CC=1
|
|
| MCULE-8458681839 |
0.73 |
O=C(C1NCCC1)NCC(C1C=CC=CC=1)CC1C=CC=CC=1
|
|
| MCULE-8347684383 |
0.73 |
CCN(C(CC1C=CC=CC=1)CNC(C1NCCC1)=O)CC
|
|
| MCULE-7180083071 |
0.73 |
N1(C)[C@@H](C)C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC2C=CC=CC=2)CNCC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-7875995748 |
0.73 |
N1(C)[C@@H](C)C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC2=CC=CC=C2)CN(C(CCC)=O)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-5869198969 |
0.73 |
CC(CCC(NCC(N(CC(=O)O)CCC1C=CC=CC=1)=O)=O)C
|
|
| MCULE-4554353015 |
0.73 |
O=C([C@H](CC1C=CC=CC=1)NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(=N)N)N)O
|
|
| MCULE-6300171991 |
0.73 |
N12CCC[C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CN(C(=O)[C@H](OC)C1C=CC=CC=1)CC(=O)N[C@@H](C)C2=O)CC1C=CC=CC=1
|
|
| MCULE-9494895919 |
0.73 |
C(N1CCC[C@H]1C(N1CCC[C@H]1C(NCC(N[C@@H](CC1=CC=CC=C1)C(O)=O)=O)=O)=O)([C@H](CCCNC(N)=N)N)=O
|
|
| MCULE-2584722357 |
0.73 |
C(=O)(C1(CCCCC1)N1CCOCC1)N1CCC(O)(C2=CC=CC=C2)C1
|
|
| MCULE-7746787487 |
0.73 |
CN1C(C(NCC(C2=C(F)C=CC=C2)O)=O)(C)CC(O)C1
|
|
| MCULE-8897321717 |
0.73 |
C1(C2C=CC=CC=2)(CC(=O)N[C@@H](CC(C)C)C(N)=O)CC(N(CCCOC)C1=O)=O
|
|
| MCULE-3764494427 |
0.73 |
OC(C1=CC=C(Cl)C=C1)CNC(C1NCC(O)C1)=O
|
|
| MCULE-5276305089 |
0.73 |
COC(C1=CC=CC=C1)CNC(C1NCC(O)C1)=O.Cl
|
|
| MCULE-3092166133 |
0.73 |
CN1C(C(N2CC(C3=CC=C(Br)C=C3)(O)C2)=O)(C)CC(O)C1
|
|
| MCULE-9301238951 |
0.73 |
C1(CCCN(CCC2C=CC=CC=2)C1=O)(O)CN1CCN(C(=O)C1)C1CCCCC1
|
|
| MCULE-4427595890 |
0.73 |
N1(C[C@H]([C@H](C(O)=O)C1)C1=CC=CC=C1)C(=O)CN1[C@@H](C)CCC[C@H]1C
|
|
| MCULE-4412191920 |
0.73 |
OC(C1=CC=CC=C1)C1N(C(CN2C(=O)CCCCCC2)=O)CCC1
|
|
| MCULE-9313638747 |
0.73 |
CC(C[C@@H](C(=O)O)NC(CNC(C1C2C=CC=CC=2C1)=O)=O)C
|
|
| MCULE-3683657505 |
0.73 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC(=O)CC(C1=CC=CC=C1)C1=CC=CC=C1
|
|
| MCULE-9177674109 |
0.73 |
OC[C@@H]1N(C(CCC2=CC=C(Cl)C=C2)=O)C[C@H]2N(CCC2)C1
|
|
| MCULE-1229862635 |
0.73 |
N1(CCC[C@H]1C(O)=O)C(=O)[C@H]1CC[C@@H](CC1)CNC(=O)[C@@H](N)CC1=CC=CC=C1
|
|
| MCULE-1166225619 |
0.73 |
N1(CCC[C@H]1C(O)=O)C(=O)C1CCN(CC1)C(=O)[C@@H](N)CC1C=CC=CC=1
|
|
| MCULE-8814765011 |
0.73 |
COC(CC(NC(C(N1CCCC1)=O)CC1C=CC=CC=1)=O)CN
|
|
| MCULE-1260178187 |
0.73 |
CC1=CC(CC(NC(C2N3C(CCCC3)CC2)=O)CO)=CC=C1
|
|
| MCULE-2413982175 |
0.73 |
N1(CCC(O)(C2=CC=CC=C2)C1)C(=O)CNC(N)=O
|
|
| MCULE-3311696676 |
0.73 |
[Cl-].C(=O)([C@H](CC1=CC=CC=C1)[NH3+])N1CCC(CC1)C(=O)N[C@@H](CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-6003130611 |
0.73 |
C12C(=O)NC(CC3C=CC=CC=3)C(=O)N1CC(OC(=O)C1C=CC=CC=1)C2
|
|
| MCULE-5283490484 |
0.73 |
N12C[C@@H](C[C@H]1C(=O)N[C@H](CC1C=CC=CC=1)C2=O)OC(C1C=CC=CC=1)=O
|
|
| MCULE-3507067164 |
0.73 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)OC(C1C=CC=CC=1)=O
|
|
| MCULE-6545664081 |
0.73 |
CCC(NC(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)CC#N
|
|
| MCULE-9042101035 |
0.73 |
CCN(C(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)CC(C#N)C
|
|
| MCULE-8652316848 |
0.73 |
CC1(C(F)(F)C1)CCNC(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O
|
|
| MCULE-1443366430 |
0.73 |
CC(C#N)CN(C(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O)C
|
|
| MCULE-9629335764 |
0.73 |
CC1=CC(C2CN(C(C34N(C5CC5)CC(C3)C4)=O)CC2)=CC=C1
|
|
| MCULE-8709712559 |
0.73 |
CCCC(C(NC(C(=O)O)C)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-5726367708 |
0.73 |
CC(C[C@@H](C(=O)O)NC(CNC(CCC1C=CC(C(C)C)=CC=1)=O)=O)C
|
|
| MCULE-5318119267 |
0.73 |
OC1CN([C@@H]2[C@H](NC(C3(CC3)CC3=CC=CC=C3)=O)CCC2)CC1
|
|
| MCULE-9766497354 |
0.73 |
OC([C@@H]1N(CC(NCCCC2C=CC=CC=2)=O)CCC1)=O
|
|
| MCULE-4767650745 |
0.73 |
CC1(N(CCO)CCN(C(C2N(C(CC3=CC=CC=C3)=O)CCC2)=O)C1)C
|
|
| MCULE-7323270829 |
0.73 |
CC(C[C@@H](C(=O)O)NC(CNC(CCC1C=CC(C)=CC=1)=O)=O)C
|
|
| MCULE-1446327193 |
0.73 |
OC([C@H]1N(CC(NCCCC2C=CC=CC=2)=O)CCC1)=O
|
|
| MCULE-9416396598 |
0.73 |
CC[C@@H]([C@@H](C(=O)O)NC(CNC(CCC1C=CC(C)=CC=1)=O)=O)C
|
|
| MCULE-3375460311 |
0.73 |
CC(C[C@H](C(=O)O)NC(CNC(CCC1C=CC(C)=CC=1)=O)=O)C
|
|
| MCULE-9925384735 |
0.73 |
CCC1C=CC(CCC(NCC(N[C@H](C(=O)O)CC(C)C)=O)=O)=CC=1
|
|
| MCULE-7839704779 |
0.73 |
CCCC(C(=O)O)NC(CNC(CCC1C=CC(C)=CC=1)=O)=O
|
|
| MCULE-4673827512 |
0.73 |
CC(C1CC1)CC(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-7231258416 |
0.73 |
OC(C1N(CC(NCCCC2C=CC=CC=2)=O)CCC1)=O
|
|
| MCULE-1427893402 |
0.73 |
N1(C[C@H]([C@](O)(C2CC2)C1)C)C(=O)CN1CCC(CC1)C1C=CC=CC=1
|
|
| MCULE-8007599093 |
0.73 |
CC(C1CCNCC1)CC(NC(C(N1CCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-7260259695 |
0.73 |
OCC1(CN(C(CNC(CC2=CC=CC=C2)=O)=O)CC1)O
|
|
| MCULE-5470163131 |
0.73 |
O=C(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)CCC1CCNCC1
|
|
| MCULE-9794776967 |
0.73 |
OC([C@@H]1N(CC(NCCCC2=CC=CC=C2)=O)CCC1)=O
|
|
| MCULE-8726167297 |
0.73 |
CCCC(C(=O)O)(NC(CNC(CCC1C=CC(C)=CC=1)=O)=O)C
|
|
| MCULE-7294671467 |
0.73 |
O=C(C1CCCC1)NC(C(N1CCCC1)=O)CC1=CC=CC=C1
|
|
| MCULE-8673778189 |
0.73 |
C(C(O)=O)[C@H](N)C(N[C@@H](CC(C)C)C(N1[C@@H](CCC1)C(N[C@H](CCCCN)C(N[C@H](C(N[C@H](CC(=O)N)C(N[C@H](CCCNC(N)=N)C(N[C@H](CCCCN)C(NCC(N1[C@H](CCC1)C(N[C@H](CCCNC(N)=N)C(N1[C@@H](CCC1)C(N1[C@@H](CCC1)C(NCC(N[C@@H](C(N[C@H](CO)C(N1[C@@H](CCC1)C(N[C@@H](C(N[C@H](CCCNC(N)=N)C(N)=O)=O)CC1C=CC=CC=1)=O)=O)=O)CC1C=CC=CC=1)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)[C@H](C)CC)=O)=O)=O)=O
|
|
| MCULE-3773869960 |
0.73 |
N12CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@@H](CCC1=CC=CC=C1)C2=O)C(=O)N1CCC(CC1)(CO)O
|
|
| MCULE-1990941699 |
0.73 |
OC(C(N1C(=O)C(CC2=CC=CC=C2)NC1=O)CC1=CC=CC=C1)=O
|
|
| MCULE-5237735734 |
0.73 |
N1[C@@H](CC2C=CC(=CC=2)OC)C(=O)N[C@H](C)C(=O)N[C@H](CN(CC(O)=O)CC(=O)N[C@@H](CC(C)C)C1=O)C(C)C
|
|
| MCULE-5066945566 |
0.73 |
Cl.CO[C@H]1C[C@@H](C(NCC2(C3=C(C)C=CC=C3)CC2)=O)NC1
|
|
| MCULE-7519419259 |
0.73 |
CO[C@@H]1CN(C)[C@H](C(NCC2(C3=CC=CC=C3)CCOCC2)=O)C1
|
|
| MolPort-046-569-867 |
0.73 |
CC(C)[C@H]1NC(=O)[C@H](CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC1=O)NC(=O)C1CCCC1
|
|
| MolPort-046-577-136 |
0.73 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC1=O)NC(=O)C1=CC2=CC=CN=C2C=C1
|
|
| MolPort-039-293-750 |
0.73 |
Cl.OC1CNC(C1)C(=O)N1CCC(CCC2=CC=CC=C2)CC1
|
|
| MolPort-046-168-747 |
0.73 |
CC(=O)N1CCC(CC(=O)N2CC(O)CN(CCC3=CC=CC=C3)C(=O)C2)CC1
|
|
| MolPort-046-567-034 |
0.73 |
CC(C)[C@H]1NC(=O)[C@H](CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC1=O)NC(=O)CC(C1=CC=CC=C1)C1=CC=CC=C1
|
|
| MolPort-023-276-021 |
0.73 |
C[C@@H](NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(=O)NCC(=O)N(C)[C@@H](CC1=CC=CC=C1)C(=O)NCCO
|
|
| MolPort-045-947-337 |
0.73 |
OC1=CC=C(C[C@@H]2NC(=O)[C@@H](NC2=O)C2CC2)C=C1
|
|
| MolPort-046-754-963 |
0.73 |
CC[C@@H]1NC(=O)[C@H](CC2=CC=C(OC[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H]3C[C@@H](O)CN3C1=O)C=C2)NC(=O)C1CCOCC1
|
|
| MolPort-045-931-789 |
0.73 |
CC[C@H](C)[C@@H]1NC(=O)CN(CC2=C(OC)C(OC)=CC=C2)CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O
|
|
| MolPort-045-962-969 |
0.73 |
CCN1CCC[C@H]1C(=O)N[C@H](C)C(O)(C1=CC=CC=C1)C1=CC=CC=C1
|
|
| MolPort-044-719-331 |
0.73 |
OC1=CC=C(C[C@H]2NC(=O)[C@@H](NC2=O)C2CC2)C=C1
|
|
| MolPort-046-568-993 |
0.73 |
CC(C)[C@H]1NC(=O)[C@H](CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC1=O)NC(=O)CCC1CCN(C)CC1
|
|
| MolPort-019-939-094 |
0.73 |
CC(C)C[C@@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](C)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@H](N)CO)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@H](CCC(N)=O)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC1=CC=CC=C1)C(N)=O
|
|
| MolPort-046-573-180 |
0.73 |
C[C@@H]1N(C)C(=O)[C@@H]2CCCN2C(=O)CN(C[C@H]2OCC[C@H](NC(=O)[C@H](CC3=CC=CC=C3)NC1=O)[C@@H]2O)C(=O)C1CCC1
|
|
| MolPort-042-665-792 |
0.73 |
CCCCCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)OC
|
|
| MolPort-046-567-767 |
0.73 |
C[C@@H]1N(C)C(=O)[C@@H]2CCCN2C(=O)CN(C[C@H]2OCC[C@H](NC(=O)[C@H](CC3=CC=CC=C3)NC1=O)[C@@H]2O)C(=O)CN1CCCCC1=O
|
|
| MolPort-046-756-048 |
0.73 |
CN1CCC2(CC1)CN(CCO2)C(=O)CN1CC(CC1=O)C1=CC=CC=C1
|
|
| MolPort-046-573-809 |
0.73 |
CC(C)C[C@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](CC2=CC=CC=C2)NC(=O)CN(C[C@H]2OCC[C@H](NC1=O)[C@@H]2O)C(=O)C1CC1
|
|
| MolPort-003-959-650 |
0.73 |
CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(C)C)C(=O)NCC(N)=O
|
|
| MolPort-045-939-753 |
0.73 |
CC(C)[C@@H]1NC(=O)COC2=CC=C(C[C@H](NC(=O)[C@H](C)NC(=O)[C@H]3CCCN3C1=O)C(=O)N1CCC(CO)CC1)C=C2
|
|
| MolPort-028-959-382 |
0.73 |
C[C@H](NC(=O)CN)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-029-943-869 |
0.73 |
CNC(=O)[C@@H](CC1=CC=CC=C1)N1CCC[C@H]1C(=O)NCC1CC1
|
|
| MolPort-045-940-128 |
0.73 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC1=O)C(=O)CC1=C(C)C=CC(C)=C1
|
|
| MolPort-046-744-346 |
0.73 |
O=C(N1C[C@H](CC2=CC=CC=C2)NC(=O)C1)C1(CCCCC1)N1CCOCC1
|
|
| MolPort-028-609-470 |
0.73 |
CNC(=O)[C@@H](CC1=CC=CC=C1)N1CCC[C@H]1C(=O)N1CCCCC1
|
|
| MolPort-045-934-603 |
0.73 |
CC(C)[C@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)C1(CCC1)C1=CC=C(Cl)C=C1
|
|
| MolPort-019-686-027 |
0.73 |
COCCCNC(=O)CN(C)C(=O)C(CC1=CC=CC=C1)N(C)C
|
|
| MolPort-045-918-437 |
0.73 |
C[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)COC2=CC=C(C[C@H](NC1=O)C(=O)N1CCC(CO)CC1)C=C2
|
|
| MolPort-046-569-024 |
0.73 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CC1=CC=C(C=C1)S(C)(=O)=O
|
|
| MolPort-045-943-455 |
0.73 |
COCC(=O)N[C@@H]1CC2N(C1)C(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H]1CCC[C@H]1NC(=O)[C@H](C)NC2=O)[C@@H](C)O
|
|
| MolPort-039-166-592 |
0.73 |
CO[C@H]1C[C@H](N(C1)C(=O)CC1=CC=C(C=C1)C(C)(C)C)C(N)=O
|
|
| MolPort-046-096-054 |
0.73 |
CC(O)C(C)(CNC(=O)C1CCCN1C)CC1=CC=CC=C1
|
|
| MolPort-009-019-446 |
0.73 |
NCCCCC(N[C@@H](CCC1=CC=CC=C1)C(O)=O)C(=O)N1CCC[C@H]1C(O)=O
|
|
| MolPort-038-385-910 |
0.73 |
O[C@@H]1C[C@@H]2N(C1)C1(CN(C1)C1CC3=CC=CC=C3C1)C(=O)N(CCCN1CCCC1=O)C2=O
|
|
| MolPort-023-276-120 |
0.73 |
C[C@H](N)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC1=CC=CC=C1)C(N)=O
|
|
| MolPort-003-848-399 |
0.73 |
NCCCC[C@H](N[C@H](CCC1=CC=CC=C1)C(O)=O)C(=O)N1CCC[C@H]1C(O)=O
|
|
| MolPort-039-161-718 |
0.73 |
Cl.CO[C@@H]1CN[C@@H](C1)C(=O)N(C)CCC1=CC=CC2=CC=CC=C12
|
|
| MolPort-023-276-266 |
0.73 |
CC[C@H](C)[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](CO)NC(=O)[C@@H]1CCCN1C(=O)[C@@H]1CCC(=O)N1)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCSC)C(N)=O
|
|
| MolPort-002-507-428 |
0.73 |
NCCCC[C@H](N[C@@H](CCC1=CC=CC=C1)C(O)=O)C(=O)N1CCC[C@H]1C(O)=O
|
|
| MolPort-020-179-700 |
0.73 |
O[C@@]1(CCN(C[C@H]1N1CCCC1)C(=O)C1CCCC1)C1=CC=CC=C1
|
|
| MolPort-045-913-264 |
0.73 |
CN(C)[C@@H]1C[C@@H]2N(C1)C(=O)[C@@H](CC1=CC=CC=C1)NC2=O
|
|
| MolPort-039-235-346 |
0.73 |
Cl.OC1CNC(C1)C(=O)NCCC1=CC=CC=C1Cl
|
|
| MolPort-045-912-903 |
0.73 |
CN(C)[C@@H]1C[C@@H]2N(C1)C(=O)[C@H](CC1=CC=CC=C1)NC2=O
|
|
| MolPort-019-939-024 |
0.73 |
C[C@@H](N)C(=O)N[C@H](CC1=CC=C(O)C=C1)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](CC1=CC=CC=C1)C(N)=O
|
|
| MolPort-002-510-845 |
0.73 |
CN[C@H](CC(C)C)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)OC
|
|
| MolPort-039-293-792 |
0.73 |
OC1CNC(C1)C(=O)NCCC1=C(F)C=CC=C1F
|
|
| MolPort-005-933-636 |
0.73 |
O.O.NCCCC[C@H](N[C@@H](CCC1=CC=CC=C1)C(O)=O)C(=O)N1CCC[C@H]1C(O)=O
|
|
| MolPort-046-765-130 |
0.73 |
N.OC(=O)CNCCCCC(NC(CCC1=CC=CC=C1)C(O)=O)C(=O)N1CCCC1C(O)=O
|
|
| MolPort-003-941-324 |
0.73 |
CCC(C)C(NC(=O)C(CC1=CC=CC=C1)NC(=O)C(C)NC(=O)C(CC(O)=O)NC(=O)C(CCCCN)NC(=O)C(CO)NC(=O)C1CCCN1C(=O)C1CCC(=O)N1)C(=O)NCC(=O)NC(CC(C)C)C(=O)NC(CCSC)C(N)=O
|
|
| MolPort-020-001-631 |
0.73 |
O.O.NCCCCC(NC(CCC1=CC=CC=C1)C(O)=O)C(=O)N1CCCC1C(O)=O
|
|
| MolPort-004-964-559 |
0.73 |
NCCCCC(NC(CCC1=CC=CC=C1)C(O)=O)C(=O)N1CCCC1C(O)=O
|
|
| MolPort-028-791-874 |
0.73 |
CC1=CC=C(CCC(=O)NCC(=O)NC(CC2=CC=C(F)C=C2)C(O)=O)C=C1
|
|
| MolPort-027-819-453 |
0.73 |
CN(C1CCCCC1)C(=O)CN1C[C@H]([C@@H](C1)C1=CC=CC=C1)C(O)=O
|
|
| MolPort-044-351-939 |
0.73 |
CNC(=O)[C@@H]1C[C@@H](O)CN1C1CCN(CC1)C(=O)CCCC1=CC=CC=C1
|
|
| MolPort-039-139-302 |
0.73 |
O.NCCCC[C@H](N[C@@H](CCC1=CC=CC=C1)C(O)=O)C(=O)N1CCC[C@H]1C(O)=O
|
|
| MolPort-046-418-715 |
0.73 |
NCCCC[C@H](NC(=O)CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)CN)C(=O)N[C@@H](CC1=CC=CC=C1)C(N)=O
|
|
| MolPort-046-567-842 |
0.73 |
CC(C)[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](C)NC(=O)CN(C[C@H](CC2=CC=CC=C2)NC1=O)C(=O)C1CCN(CC1)C(C)=O
|
|
| MolPort-046-682-877 |
0.73 |
OC(=O)C(F)(F)F.COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CCC1=CC=CC=C1
|
|
| MolPort-044-747-107 |
0.73 |
OC(CNC(=O)[C@H]1CCC(=O)N1)C1=CC2=CC=CC=C2C=C1
|
|
| MolPort-044-710-343 |
0.73 |
CN(C)[C@@H](CC1=CC=CC=C1)C(=O)NC1(CO)CCCCCC1
|
|
| MolPort-046-568-249 |
0.73 |
CC(C)[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](C)NC(=O)CN(C[C@H](CC2=CC=CC=C2)NC1=O)C(=O)CCCN1CCCCC1=O
|
|
| MolPort-046-569-160 |
0.73 |
CC(C)[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](C)NC(=O)CN(C[C@H](CC2=CC=CC=C2)NC1=O)C(=O)CN1CCC(CC1)C(N)=O
|
|
| MolPort-039-689-229 |
0.73 |
OC(C1CCCCC1)C(=O)NC(CC1=CC=CC=C1)C(=O)N1CCOCC1
|
|
| MolPort-044-700-994 |
0.73 |
CN(C)[C@@H](CC1=CC=CC=C1)C(=O)NC1(CO)CCCCC1
|
|
| MolPort-046-144-918 |
0.73 |
OCC1CCCN(C1)C(=O)C1CCCN1C(=O)CC1=CC=CC=C1
|
|
| MolPort-027-665-656 |
0.73 |
OC(CNC(=O)C1CCC(=O)N1)C1=CC2=CC=CC=C2C=C1
|
|
| MolPort-035-765-936 |
0.73 |
CC[C@H](C)[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)NCC(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CCC(N)=O)C(O)=O
|
|
| MolPort-035-697-039 |
0.73 |
CN(C)[C@@H]1CN(CC[C@]1(O)C1=CC=CC=C1)C(=O)CCC1=CC=CC=C1
|
|
| MolPort-039-110-326 |
0.73 |
CN1C[C@H](C[C@H]1C(O)=O)NC(=O)[C@@H](N)CC1=CC=C(O)C=C1
|
|
| MolPort-039-227-706 |
0.73 |
CC(C)(CC(=O)N1C[C@H](O)[C@H](C1)N1CCCCC1)C1=CC=CC=C1
|
|
| MolPort-044-675-964 |
0.73 |
O[C@@H]1C[C@@H]2N(C1)C(=O)[C@@H](CC1=CNC3=CC=CC=C13)NC2=O
|
|
| MolPort-035-765-952 |
0.73 |
CC(C)C[C@H](NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](N)CCCCN)C(C)C)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCCCCC(NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CO)NC(=O)[C@@H](NC(=O)CNC(=O)[C@@H](N)CCCCN)C(C)C)C(N)=O
|
|
| MolPort-005-159-020 |
0.73 |
CCN1CCN(CC1)C1(CC2=CC=CC=C2C1)C(=O)N1CCC[C@H]1CO
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O[C@@H]1C[C@@H]2N(C1)C(=O)[C@H](CC1=CNC3=CC=CC=C13)NC2=O
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NC(=O)CC[C@H](NC(=O)C1(CCN(CC1)C(=O)[C@@H]1CCCN1)C1=CC=CC=C1)C(O)=O
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CC(C)C[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](C)N(C)C1=O)C(=O)CCCNC(C)=O
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COCCN1CCN2[C@@H](CN([C@@H](CC3=CC=CC=C3)C2=O)C(=O)C2CCC2)C1=O
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CC(C)(CO)C(CNC(=O)CN1CCCCCCC1=O)C1=CC=CC=C1
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COC(=O)CN1C(=O)[C@@H]2C[C@@H](O)CN2C2(CN(C2)C2CC3=CC=CC=C3C2)C1=O
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CC(C)OCCC(=O)NC(CC1=CC=CC=C1)C(=O)N1CCCC1
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| MolPort-002-528-840 |
0.72 |
CCC(C)[C@H](N)C(=O)N1CCC(CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-044-639-123 |
0.72 |
CO[C@H]1C[C@H]2CN([C@@H](CC3=CC=CC=C3)C(=O)N2C1)C(=O)NCC1=CC=CC=C1
|
|
| MolPort-009-584-059 |
0.72 |
CC(C)(C)CC(=O)NC(CC1=CC=CC=C1)C(=O)N1CCCC1
|
|
| MolPort-002-531-375 |
0.72 |
C[C@@H](N)C(=O)NC[C@H]1CC[C@@H](CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-044-350-311 |
0.72 |
CNC(=O)[C@H]1C[C@@H](CN1C(=O)CCC1=CC=CC=C1)OC1=CC=CC=C1
|
|
| MolPort-046-085-964 |
0.72 |
CC(O)(CNC(=O)C1CCCN1C(=O)CC1=CC=CC=C1)C(F)(F)F
|
|
| MolPort-002-514-723 |
0.72 |
O=C1CN(CCC2=CC=CC=C2)C(=O)[C@@H]2CCCN12
|
|
| MolPort-044-360-225 |
0.72 |
CNC(=O)[C@@H]1C[C@@H](CN1C(=O)CCC1=CC=CC=C1)OC1=CC=CC=C1
|
|
| MolPort-044-360-328 |
0.72 |
COCCNC(=O)[C@@H]1C[C@@H](CN1C(=O)CCC1=CC=CC=C1)OC1=CC=CC=C1
|
|
| MolPort-044-360-441 |
0.72 |
O=C(CCC1=CC=CC=C1)N1C[C@H](C[C@H]1C(=O)N1CCCC1)OC1=CC=CC=C1
|
|
| MolPort-039-047-573 |
0.72 |
O[C@@H](CC1=CC=CC=C1)C(=O)N1CCN(C2CCCCC2)C(=O)C1
|
|
| MolPort-023-276-406 |
0.72 |
CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H]1CCCN1C(=O)[C@H](CC(C)C)NC(=O)[C@@H](N)CC(O)=O)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)NCC(=O)N1CCC[C@H]1C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CO)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O
|
|
| MolPort-046-171-127 |
0.72 |
CN1CCC(CC(=O)N2CC(O)CN(CCC3=CC=CC=C3)C(=O)C2)CC1
|
|
| MolPort-002-508-656 |
0.72 |
CC(C)CC(NC(=O)[C@H]1CCCN1C(=O)CNC(=O)[C@H](C)NC(=O)[C@H](N)CC1=CC=C(O)C=C1)C(=O)NCC(N)=O
|
|
| MolPort-028-960-427 |
0.72 |
O=C1N[C@@H](CC2=CC=CC=C2)C(=O)N[C@H]1CC1=CC=CC=C1
|
|
| MolPort-002-319-956 |
0.72 |
O=C1NC(CC2=CC=CC=C2)C(=O)NC1CC1=CC=CC=C1
|
|
| MolPort-002-533-171 |
0.72 |
CCC(C)[C@H](N)C(=O)NC[C@H]1CC[C@@H](CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-002-531-762 |
0.72 |
CC[C@@H](C)[C@H](NC(=O)C1CCN(CC1)C(=O)[C@@H](N)CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-002-522-246 |
0.72 |
CC(C)C[C@H](N)C(=O)N1CCC(CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-019-675-604 |
0.72 |
CC(C)CC(=O)NC(CC1=CC=CC=C1)C(=O)N1CCCC1
|
|
| MolPort-045-933-228 |
0.72 |
C[C@@H](O)[C@@H]1NC(=O)[C@@H]2CCC[C@H]2NC(=O)[C@H](C)NC(=O)[C@@H]2C[C@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)CCC1=CC=C(F)C=C1
|
|
| MolPort-002-536-598 |
0.72 |
CC(C)C[C@H](NC(=O)C1CCN(CC1)C(=O)[C@@H](N)CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-002-538-147 |
0.72 |
COC(=O)CCCNC(=O)CN1CC(CC1=O)C1=CC=CC=C1
|
|
| MolPort-021-675-945 |
0.72 |
CC(C)C1NC(=O)C(CC2=CC=CC=C2)NC1=O
|
|
| MolPort-002-532-974 |
0.72 |
CC(C)[C@@H](N)C(=O)NC[C@H]1CC[C@@H](CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MCULE-4799561123 |
0.72 |
CC(CC(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)=O)(C)C
|
|
| MCULE-6095032224 |
0.72 |
N1(C[C@H](C[C@@H]1C(NC)=O)OC1C=CC=CC=1)C(CCC1=CC=CC=C1)=O
|
|
| MCULE-3167439083 |
0.72 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(CCC1=CC=C(C=C1)F)=O
|
|
| MCULE-5754093322 |
0.72 |
N1(CC(CC1C(NC)=O)OC1C=CC=CC=1)C(CCC1=CC=CC=C1)=O
|
|
| MCULE-5602956747 |
0.72 |
N1(C[C@H](C[C@H]1C(NC)=O)OC1C=CC=CC=1)C(CCC1=CC=CC=C1)=O
|
|
| MCULE-8985700596 |
0.72 |
N1(CC(CC1C(=O)N1CCCC1)OC1=CC=CC=C1)C(CCC1=CC=CC=C1)=O
|
|
| MCULE-4661970278 |
0.72 |
N1(C[C@H](C[C@H]1C(NCCOC)=O)OC1C=CC=CC=1)C(CCC1=CC=CC=C1)=O
|
|
| MCULE-7949311849 |
0.72 |
CC[C@@H]([C@H](NC([C@@H](NC([C@@H](NC([C@@H](NC([C@@H](N)CCCCN)=O)[C@H](O)C)=O)CCC(O)=O)=O)CCC(O)=O)=O)C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H]([C@@H](O)CC(N[C@H](C(N[C@H](C(N[C@H](C(N[C@H](C(O)=O)CC1C=CC=CC=1)=O)CCC(O)=O)=O)C)=O)C(C)C)=O)CC(C)C)=O)CC(N)=O)=O)C(C)C)=O)CCC(O)=O)=O)CO)=O)C
|
|
| MCULE-9176745113 |
0.72 |
N1(C[C@H](C[C@H]1C(=O)N1CCCC1)OC1=CC=CC=C1)C(CCC1=CC=CC=C1)=O
|
|
| MCULE-8815071613 |
0.72 |
CC(C(F)(F)F)(CNC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O)O
|
|
| MCULE-6710124366 |
0.72 |
C(=O)([C@H]1CC[C@@H](CC1)CNC([C@@H](C)N)=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MCULE-8424558837 |
0.72 |
N1(C[C@@H]2C[C@@H](CN2C(=O)[C@@H]1CC1=CC=CC=C1)OC)C(=O)NCC1C=CC=CC=1
|
|
| MCULE-8809176227 |
0.72 |
N1(CCN(C(=O)C1)C1CCCCC1)C(=O)[C@@H](O)CC1C=CC=CC=1
|
|
| MCULE-7985273940 |
0.72 |
C(=O)([C@H]1CC[C@@H](CC1)CNC(=O)[C@H](C(C)C)N)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MCULE-3667550798 |
0.72 |
C(=O)([C@@H](N)CC1C=CC=CC=1)N1CCC(CC1)C(=O)N[C@H](CC(C)C)C(O)=O
|
|
| MCULE-9567035237 |
0.72 |
N1(CC(NCCCC(OC)=O)=O)CC(CC1=O)C1=CC=CC=C1
|
|
| MCULE-3682099110 |
0.72 |
N1(CC(O)CN(CCC2C=CC=CC=2)C(=O)C1)C(=O)CC1CCN(CC1)C
|
|
| MCULE-5378848417 |
0.72 |
NC(C(NC(C12CC3CC(C1)(CC(C3)C2)O)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-5860642423 |
0.72 |
CC1CC(C(=O)O)N(C(CN(C(=O)C)CCC2C=CC=CC=2)=O)CC1
|
|
| MCULE-7333456365 |
0.72 |
C(=O)([C@H]1CC[C@@H](CC1)CNC(=O)[C@@H](C(C)C)N)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MCULE-7647818211 |
0.72 |
N([C@@H]([C@H](C)CC)C(O)=O)C(=O)C1CCN(CC1)C(=O)[C@@H](N)CC1=CC=CC=C1
|
|
| MCULE-2508283560 |
0.72 |
C(=O)([C@@H](N)CC(C)C)N1CCC(CC1)C(=O)N[C@H](CC1=CC=CC=C1)C(O)=O
|
|
| MCULE-4249179788 |
0.72 |
C(=O)([C@@H](N)CC1=CC=CC=C1)N1CCC(CC1)C(=O)N[C@@H](CC(C)C)C(O)=O
|
|
| MCULE-1472560804 |
0.72 |
C(=O)([C@@H](N)CC(C)C)N1CCC(CC1)C(=O)N[C@@H](CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-6188144929 |
0.72 |
CC(N(CC(N1C(C(O)=O)CCCC1)=O)CCC1=CC=CC=C1)=O
|
|
| MCULE-8823150473 |
0.72 |
CC(N(CC(N1[C@@H](C(=O)O)CCCC1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-2851335401 |
0.72 |
C(=O)(N1CCOCC1)C(CC1C=CC=CC=1)NC(=O)C1CCC(CC1)C(C)C
|
|
| MCULE-2147535306 |
0.72 |
CN1C(C(NCC(C2=C(Cl)C=CC=C2)(O)C)=O)(C)CC(O)C1
|
|
| MCULE-1315621915 |
0.72 |
C(=O)(N1CCOCC1)[C@H](CC1C=CC=CC=1)NC(=O)[C@H]1CC[C@@H](CC1)C(C)C
|
|
| MCULE-9054339249 |
0.72 |
N1(C(=O)CNC1=O)CC(=O)N1CCC(O)(C2C=CC=CC=2)C1
|
|
| MCULE-6728533397 |
0.72 |
Cl.C(=O)(N[C@@H](CCC(N)=O)C(O)=O)C1(C2C=CC=CC=2)CCN(CC1)C(=O)[C@@H]1CCCN1
|
|
| MCULE-6003668765 |
0.72 |
OC(C1C=CC=CC=1Cl)CNC(C1NCC(O)C1)=O
|
|
| MCULE-5746465383 |
0.72 |
N1(C[C@@H](C[C@H]1C(NC)=O)O)C1CCN(CC1)C(=O)CC1=CC=CC=C1C
|
|
| MCULE-4666429285 |
0.72 |
C(=O)(N1CCOCC1)[C@@H](CC1C=CC=CC=1)NC(=O)[C@H]1CC[C@@H](CC1)C(C)C
|
|
| MCULE-1598292620 |
0.72 |
N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1=CC=C(C=C1)OC)C(=O)CCO
|
|
| MCULE-2388528887 |
0.72 |
CCC1(CCOCC1)CNC(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O
|
|
| MCULE-3588767942 |
0.72 |
C1(CNC([C@H](CCCNC(=N)N)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@@H](CC2=CC=CC=C2)NC[C@H](CC(O)=O)N1)=O)=O
|
|
| MCULE-7581617820 |
0.72 |
N12CCC[C@@H]1C(=O)NCCOC1C=CC(C[C@H](NC(C)=O)C(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C2=O)=CC=1
|
|
| MCULE-7157416477 |
0.72 |
C(N1CCC[C@H]1C(N[C@@H](CCCCN)C(N1CCC[C@H]1C(N[C@@H](CCC(N)=O)C(N[C@@H](CCC(N)=O)C(N[C@@H](CC1=CC=CC=C1)C(N[C@@H](CC1=CC=CC=C1)C(NCC(O)=O)=O)=O)=O)=O)=O)=O)=O)([C@H](CCCNC(N)=N)N)=O
|
|
| MCULE-3713815143 |
0.72 |
CO[C@@H]1CN(C(CC2=C(O)C=CC=C2)=O)[C@H](C(N2CCCC2)=O)C1
|
|
| MCULE-4734704879 |
0.72 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)OCC(=O)N[C@H](CC1C=CC=CC=1)C2=O)C(=O)N1CCC(CC1)(O)C1C=CC=CC=1
|
|
| MCULE-6318118702 |
0.72 |
N12CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@@H](CCC1=CC=CC=C1)C2=O)C(NCCCO)=O
|
|
| MCULE-5282152832 |
0.72 |
OC([C@H](NC(CNCC1CC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-1898672233 |
0.72 |
CN1[C@@H](C(NCC(C2=CC=CC=C2)O)=O)CCC1
|
|
| MCULE-7768174881 |
0.72 |
COCCCNC(CN(C(C(CC1C=CC=CC=1)N)=O)C)=O
|
|
| MCULE-2670768583 |
0.72 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(CC(=O)N[C@@H]([C@@H](C)CC)C2=O)C(=O)CN1C=C(C=N1)C)O
|
|
| MCULE-3819823417 |
0.72 |
CN(C(CCCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)=O)C
|
|
| MCULE-6312492467 |
0.72 |
CC(NC(CCCC(N(C(C(=O)O)CC1C=CC=CC=1)C)=O)=O)C
|
|
| MCULE-2092966735 |
0.72 |
CCNC(CCCC(N(C(C(=O)O)CC1C=CC=CC=1)C)=O)=O
|
|
| MCULE-4131286692 |
0.72 |
CC(N(CC(NC1(C(=O)O)CCC1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-9774895201 |
0.72 |
CC(NC(CCCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)=O)C
|
|
| MCULE-3661074999 |
0.72 |
Cl.CC(C(C(NC(C(O)=O)CC1=CC=CC=C1)=O)N)C
|
|
| MCULE-2885658410 |
0.72 |
CN(C(CCCC(NC(C(=O)O)CC1C=CC=CC=1)=O)=O)C
|
|
| MCULE-6527905202 |
0.72 |
CCN(C(CCCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)=O)CC
|
|
| MCULE-6765067346 |
0.72 |
CC(NC(CCCC(NC(C(=O)O)CC1C=CC=CC=1)=O)=O)C
|
|
| MCULE-5363013042 |
0.72 |
CCCC(C(NC[C@@H](O)C)=O)NC(CC1=CC=CC=C1)=O
|
|
| MCULE-4289994180 |
0.72 |
CCNC(CCCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)=O
|
|
| MCULE-2183399312 |
0.72 |
CC(N(CC(NC(C(=O)O)C1CC1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-9718171687 |
0.72 |
CN(C(CCCC(N(C(C(=O)O)CC1C=CC=CC=1)C)=O)=O)C
|
|
| MCULE-2266457394 |
0.72 |
CNC(CCCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)=O
|
|
| MCULE-4945647162 |
0.72 |
CCCNC(CCCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)=O
|
|
| MCULE-1142971558 |
0.72 |
CCNC(CCCC(NC(C(=O)O)CC1C=CC=CC=1)=O)=O
|
|
| MCULE-6393382351 |
0.72 |
CN1[C@@H](C(NCC(C2=CC=CC=C2)(O)C)=O)CCC1
|
|
| MCULE-5730660890 |
0.72 |
COCCCNC(C(N1CCN(C(C(CC2=CC=CC=C2)N)=O)CC1)C)=O
|
|
| MCULE-3985842790 |
0.72 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)C1C=CC(=C(O)C=1)OC)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-8081765219 |
0.72 |
N1(C(C)C)CCC(CC1)CC(=O)N[C@@H](CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-9581781007 |
0.72 |
CC(C1=CC=CC=C1)C(N1[C@@H](CO)CN2[C@@H](CCC2)C1)=O
|
|
| MCULE-8254817306 |
0.72 |
C(C1C=CC=CC=1)(C1C=CC=CC=1)[C@@H](C(=O)NCCCCCCNC(=O)[C@@H](NC([C@@H]1CCCN1C(=O)[C@H](C1CCCCC1)NC(=O)[C@H](C)NC)=O)C(C1C=CC=CC=1)C1C=CC=CC=1)NC([C@@H]1CCCN1C(=O)[C@H](C1CCCCC1)NC(=O)[C@H](C)NC)=O
|
|
| MCULE-3282772747 |
0.72 |
OC(C1CN(C(C2N(C(CC3=CC=CC=C3)=O)CCC2)=O)CC1)=O
|
|
| MCULE-2760842082 |
0.72 |
CCCC(N1C(C(NC(CC2C=CC=CC=2)CCC(=O)O)=O)CCC1)=O
|
|
| MCULE-9220854516 |
0.72 |
CC(CC(N1C(C(NC(CC2C=CC=CC=2)CCC(=O)O)=O)CCC1)=O)(C)C
|
|
| MCULE-8575978681 |
0.72 |
OC([C@H]1N(CC(NCC2(C3C=CC=CC=3)CCCC2)=O)CCC1)=O
|
|
| MCULE-5026226252 |
0.72 |
OC([C@@H]1N(CC(NCC2(C3=CC=CC=C3)CCCC2)=O)CCC1)=O
|
|
| MCULE-1754157898 |
0.72 |
N1(CC(=O)N[C@H](CO)CC2C=CC=CC=2)C(=O)CC2(CCCC2)C1=O
|
|
| MCULE-1759714271 |
0.72 |
OC([C@@H]1N(CC(NCC2(C3C=CC=CC=3)CCCC2)=O)CCC1)=O
|
|
| MCULE-5348321189 |
0.72 |
CCCC(C(NCC(C(=O)O)(O)C)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-3612506080 |
0.72 |
OC(C1N(CC(N2CCC(NC(CCC3C=CC=CC=3)=O)CC2)=O)CCC1)=O
|
|
| MCULE-4780856351 |
0.72 |
CC1=C([C@H]2[C@H](C(N3[C@@H](CO)CN4[C@@H](CCC4)C3)=O)C2)C=CC=C1
|
|
| MCULE-7910574789 |
0.72 |
N1(CC(=O)NC(CO)CC2C=CC=CC=2)C(=O)CC2(CCCC2)C1=O
|
|
| MCULE-3387076694 |
0.72 |
OC([C@H]1N(CC(N2CCC(NC(CCC3C=CC=CC=3)=O)CC2)=O)CCC1)=O
|
|
| MCULE-5287281663 |
0.72 |
OC(C1N(CC(NCC2(C3C=CC=CC=3)CCCC2)=O)CCC1)=O
|
|
| MCULE-6220057132 |
0.72 |
C1(N(C)C)(CC2C(=CC=CC=2)C1)C(=O)N1CC[C@H](O)C1
|
|
| MCULE-6453913128 |
0.72 |
CC(C1=C(C)C=CC=C1)CC(NC1C(=O)N(CC(O)=O)CCCC1)=O
|
|
| MCULE-5298093158 |
0.72 |
CC1(C(=O)O)CN(C(C2N(C(CC3C=CC=CC=3)=O)CCC2)=O)CC1
|
|
| MCULE-4242957252 |
0.72 |
C(=O)([C@@H](N)CC1C=CC=CC=1)N1CCC(CC1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
|
|
| MCULE-4392928922 |
0.72 |
COCC1(CCNCC1)CNC(C1N(C(CC2C=CC=CC=2)=O)CCC1)=O
|
|
| MCULE-3171839400 |
0.72 |
C1(C([C@H](NC([C@@H]2CCCN2C([C@H](C2CCCCC2)NC(=O)[C@H](C)NC)=O)=O)C(NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]2CCCN2C(=O)[C@H](C2CCCCC2)NC(=O)[C@H](C)NC)C(C2C=CC=CC=2)C2=CC=CC=C2)=O)C2=CC=CC=C2)C=CC=CC=1
|
|
| MCULE-9503888265 |
0.72 |
CC([C@@H](C(N1C[C@@H](CC2=CC=CC=C2)[C@H](O)C1)=O)NC(N)=O)C
|
|
| MCULE-6904921015 |
0.72 |
CCCC(C(=O)O)NC(C(NC(C1C=CC=CC=1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-9682761690 |
0.72 |
C(=O)(C(CC(C)C)NC(=O)C(N)CC1C=CC=CC=1)NC(CCCNC(N)=N)C(O)=O
|
|
| MCULE-3804140206 |
0.72 |
CO[C@@H]1CN(C)[C@H](C(NCC2(C3=CC=C(Cl)C=C3)CC2)=O)C1
|
|
| MCULE-9241492141 |
0.72 |
CO[C@@H]1CN(C)[C@H](C(NCC2(C3=CC(F)=CC=C3)CC2)=O)C1
|
|
| MCULE-1517922166 |
0.72 |
CN(C1[C@H](O)CN(C(C2C(C3=C(C)C=CC=C3)C2)=O)C1)CC(O)=O
|
|
| MCULE-1578241728 |
0.72 |
N1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C(C)C)NC(CN(C(=O)CC2C=CC(=C(F)C=2)F)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-9970559240 |
0.72 |
C(=O)(C(CC1C=CC=CC=1)NC(C1C=CC=CC=1)=O)NC(CC(C)C)C(O)=O
|
|
| MCULE-1323609213 |
0.72 |
OC(C(NC(C(C1C=CC=CC=1)N1C(=O)CCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-8736512972 |
0.72 |
N1C2(CCOCC2)C(=O)N[C@@H](CC2=CC=C(C=C2)O)C1=O
|
|
| MCULE-6514808169 |
0.72 |
C(=O)([C@]([H])(CC(C)C)NC(=O)[C@]([H])(N)CC1C=CC=CC=1)N[C@@]([H])(CCCNC(N)=N)C(O)=O
|
|
| MCULE-1925519457 |
0.72 |
N1C2(CCOCC2)C(=O)N[C@H](CC2C=CC(=CC=2)O)C1=O
|
|
| MCULE-6669432931 |
0.72 |
COC1CN(C(CNC(CC2C=CC=CC=2)=O)=O)C(C(=O)O)C1
|
|
| MCULE-8420186448 |
0.72 |
CC(C[C@H](C(=O)O)NC(C(NC(C1C=CC=CC=1)=O)CC1C=CC=CC=1)=O)C
|
|
| MCULE-8515535539 |
0.72 |
C(=O)(C1(C2C=CC=CC=2)CCN(CC1)C(=O)OC(C)(C)C)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MCULE-2471255900 |
0.72 |
C(=O)(C1(C2C=CC=CC=2)CCN(CC1)C(=O)OC(C)(C)C)N1CCCC1C(=O)NC(CC1=CC=CC=C1)C(O)=O
|
|
| MCULE-5297657443 |
0.72 |
O=C(C(F)(F)F)O.O=C(C[C@@H]1NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](C(C)C)N(C)C(=O)[C@@H](CC2C=CC=CC=2)NC1=O)O
|
|
| MCULE-8428847233 |
0.72 |
C(O)(=O)C(F)(F)F.C([C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N1)C1C=CC=CC=1
|
|
| MCULE-6856237672 |
0.72 |
C1(=O)[C@@H]2CCCN2C(=O)CN(C[C@H]2OCC[C@@H]([C@@H]2O)NC(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@H](C)N1C)C(COC)=O
|
|
| MCULE-3635208046 |
0.72 |
CC1([C@H](C2=CC=CC=C2)[C@H]1C(N[C@]1(C(N)=O)C[C@H](O)C1)=O)C
|
|
| MCULE-4373890096 |
0.72 |
N([C@@H](C(C)C)C(O)=O)C(=O)C1CCN(CC1)C(=O)[C@@H](N)CC1C=CC=CC=1
|
|
| MCULE-9272910418 |
0.72 |
CC(CCC(NCC(NCC(C(=O)O)CC1C=CC=CC=1)=O)=O)C
|
|
| MCULE-5351278348 |
0.72 |
CC(C[C@@H](C(=O)O)NC(CNC(C1(C2C=CC=CC=2)CC1)=O)=O)C
|
|
| MCULE-6185364267 |
0.72 |
CC(N(CC(NC(C(=O)O)CC1CC1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-4570198590 |
0.72 |
NC1C2CC(C(NC(C(NC3CC3)=O)CC3C=CC=CC=3)=O)CC1CCC2
|
|
| MCULE-6090979319 |
0.72 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NCCN(C(=O)C2CCN(CC2)C)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-4075745357 |
0.72 |
N1(C[C@H](CC)NC(=O)[C@H](CC2=CC=CC=C2)NC([C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C1)=O)C(C1CCNCC1)=O
|
|
| MCULE-4493443068 |
0.72 |
O=C(C1N(C(C2CCCCC2)=O)CCC1)NC1C(C2=CC=CC=C2)C1
|
|
| MCULE-8679215241 |
0.72 |
CCCC(N1C(C(N2CC(C3=C(C)C=CC=C3)CC2)=O)CCC1)=O
|
|
| MCULE-2674220571 |
0.72 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)NCCN(C(=O)C2CCN(CC2)CC(N)=O)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-9632760427 |
0.72 |
CC(N(CC(NC1(C(O)=O)CCCC1)=O)CCC1=CC=CC=C1)=O
|
|
| MCULE-4668792011 |
0.72 |
CC(C[C@@H](C(=O)O)NC(CNC(CC(C1C=CC=CC=1)C1C=CC=CC=1)=O)=O)C
|
|
| MCULE-1860500259 |
0.72 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NCCN(C(=O)CCC(=O)N(C)C)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-4361233087 |
0.72 |
C(=O)(C1CCCN1)NCC([H])(C1=CC=C(C=C1)Cl)CC(NCCCC(O)=O)=O
|
|
| MCULE-2068266496 |
0.72 |
C(=O)([C@H]1CC[C@@H](CC1)C(C)C)N[C@@H](CC1C=CC=CC=1)C(=O)NCC1CCOCC1
|
|
| MCULE-4533610459 |
0.72 |
COC1=CC=C(C2CCN(C(C3(N(C)CC(O)C3)C)=O)CC2)C=C1
|
|
| MCULE-2665389946 |
0.72 |
N1(CCN(C(C(O)=O)C1)C)C(=O)C1(C2=CC=CC=C2)CCN(CC1)C
|
|
| MCULE-8653093037 |
0.72 |
CO[C@H]1C[C@@H](C(N2CCC(C3=C(C)C=CC=C3)CC2)=O)NC1
|
|
| MCULE-1684847565 |
0.72 |
OC([C@H]1N(CC(NCC2(C3C=CC=CC=3)CCOCC2)=O)CCC1)=O
|
|
| MCULE-2241837301 |
0.72 |
OC([C@@H]1N(CC(NCC2(C3C=CC=CC=3)CCOCC2)=O)CCC1)=O
|
|
| MCULE-8996192880 |
0.72 |
Cl.COC1=CC=C(CCCNC(C2NCC(O)C2)=O)C=C1
|
|
| MCULE-5121113636 |
0.72 |
C(F)(F)(F)C(=O)O.C(N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@H](C(=O)N)CC1C=CC=CC=1)(=O)[C@@H](NC([C@@H](N)C)=O)CC1C=CC(O)=CC=1
|
|
| MCULE-7862846604 |
0.72 |
OC(C1N(CC(NCC2(C3C=CC=CC=3)CCOCC2)=O)CCC1)=O
|
|
| MCULE-3565455329 |
0.72 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC(=O)[C@@H]1CCCO1
|
|
| MCULE-4092660204 |
0.72 |
Cl.C(=O)([C@@H]1CCCN1)NC[C@@]([H])(C1=CC=C(C=C1)Cl)CC(NCCCC(O)=O)=O
|
|
| MCULE-7855009219 |
0.72 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(=O)[C@H]1CCCO1
|
|
| MCULE-5963852420 |
0.72 |
OC([C@@H]1N(CC(NCC2(C3=CC=CC=C3)CCOCC2)=O)CCC1)=O
|
|
| MCULE-8476544176 |
0.72 |
C(N)(=O)[C@H](CCSC)NC(=O)[C@H](CC(C)C)NC(=O)CNC(=O)[C@H](C(C)C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CO)NC(=O)[C@H](CC(O)=O)N.OC(=O)C(F)(F)F
|
|
| MCULE-7477643465 |
0.72 |
C1(CC2C(=CC=CC=2)C1)(N1CCCCC1)C(=O)N1CCC[C@H]1CO
|
|
| MCULE-8192796696 |
0.72 |
N12C[C@@H](CC1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)=O)NC(=O)CN1CCOCC1
|
|
| MCULE-1143519532 |
0.72 |
C(=O)([C@@H]1CCCN1)NC[C@@]([H])(C1=CC=C(C=C1)Cl)CC(NCCCC(O)=O)=O
|
|
| MCULE-2498584086 |
0.72 |
N1(C[C@H]2C(=O)N(CCOC)CCN2C(=O)[C@@H]1CC1C=CC=CC=1)C(C1CCC1)=O
|
|
| MCULE-4641402529 |
0.72 |
C(=O)([C@H]1CC[C@@H](CC1)C(C)C)N[C@H](CC1C=CC=CC=1)C(=O)NCC1CCOCC1
|
|
| MCULE-8036320050 |
0.72 |
[C@@H]12CN(C(=O)CC3CC3)[C@H](C(=O)N1CCN(CCOC)C2=O)CC1C=CC=CC=1
|
|
| MCULE-4741857224 |
0.72 |
N1(CCN(C[C@@H]1C1C=CC=CC=1)C)C(=O)[C@@H]1C[C@H](CN1)O
|
|
| MCULE-1274878919 |
0.72 |
O[C@H]1C[C@H](C(NCC2(C3=CC=C(F)C=C3)CCOCC2)=O)NC1
|
|
| MCULE-5867173199 |
0.72 |
C(=O)([C@H](CC1C=CC=CC=1)[NH3+])N1CCC(CC1)C(=O)N[C@H](C(O)=O)CC(O)=O.[Cl-]
|
|
| MCULE-8698789235 |
0.72 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(=O)C1CCN(CC1)C(COCC)=O)C
|
|
| MCULE-8351590995 |
0.72 |
C(=O)(C1CCC(CC1)C(C)C)NC(CC1C=CC=CC=1)C(=O)NCC1CCOCC1
|
|
| MCULE-8322891256 |
0.72 |
C1(CCCN(CCC2C=CC=CC=2)C1=O)(O)CN1CCN(C(=O)C1)CC(OC)=O
|
|
| MCULE-9610460325 |
0.72 |
OC1C(=O)N(CC(NCC2(C3=CC=C(F)C=C3)CC2)=O)CCCC1
|
|
| MCULE-4404330116 |
0.72 |
N1(CC2C(=O)N(CCOC)CCN2C(=O)C1CC1C=CC=CC=1)C(C1CCC1)=O
|
|
| MCULE-2003223099 |
0.72 |
[C@@H]1(C(O)=O)CN(C[C@H]1C1C=CC=CC=1C)C(=O)CN1CCCCCC1=O
|
|
| MCULE-6820706067 |
0.72 |
O=C(N1CCN(C2COCC2)CC1)C1C(C2=CC=CC=C2)CCCN1
|
|
| MCULE-5757684107 |
0.72 |
CO[C@@H]1CN(C(CCC2=CC=C(OC)C=C2)=O)[C@H](C(N)=O)C1
|
|
| MCULE-9354067642 |
0.72 |
C12CN(C(=O)CC3CC3)C(C(=O)N1CCN(CCOC)C2=O)CC1C=CC=CC=1
|
|
| MCULE-4325228989 |
0.72 |
CCCCC(C(=O)O)NC(C(NC(C1C=CC=CC=1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-4405399551 |
0.72 |
OC(CN(C(CN1C(=O)CCCCCC1)=O)CCC1=CC=CC=C1)=O
|
|
| MCULE-3656069578 |
0.72 |
C12C(=O)NC(C(NC(CO)C(=O)NC(CCCCCCCCCCC(C)C)CC(=O)NC(CC(N)=O)C(=O)NC(CC3C=CC(O)=CC=3)C(=O)NC(CC(=O)N)C(=O)NC(CCC(=O)N)C(=O)N1CCC2)=O)CC(=O)N
|
|
| MCULE-5575521503 |
0.72 |
N1(CCNC(=O)C1CC1C=CC=CC=1)C(=O)CC12CC3CC(CC(C3)C1)C2
|
|
| MCULE-7286214846 |
0.72 |
C12C(=O)NC(C(NC(CO)C(=O)NC(CC(=O)NC(CC(N)=O)C(=O)NC(CC3C=CC(O)=CC=3)C(=O)NC(CC(=O)N)C(=O)NC(CCC(=O)N)C(=O)N1CCC2)CCCCCCCCCCC(C)CC)=O)CC(=O)N
|
|
| MCULE-6493580034 |
0.72 |
OC1CN([C@@H]2[C@H](NC(C3(CC3)CC3=CC=CC=C3)=O)CCC2)CC1.I
|
|
| MCULE-5732807346 |
0.72 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N[C@H]2CCO[C@@H]([C@H]2O)CNCC(=O)N[C@H](CC(C)C)C1=O
|
|
| MCULE-9987971435 |
0.72 |
Cl.OC(C1N(CC(NCCCC2C=CC=CC=2)=O)CCC1)=O
|
|
| MCULE-1402505460 |
0.72 |
C12C(=O)NC(C(NC(CO)C(=O)NC(CCCCCCCCCCC)CC(NC(CC(N)=O)C(=O)NC(CC3C=CC(O)=CC=3)C(=O)NC(CC(=O)N)C(=O)NC(CCC(=O)N)C(=O)N1CCC2)=O)=O)CC(=O)N
|
|
| MCULE-2055838427 |
0.72 |
O=C(C1CCCCC1)NC(C(N1CCCC1)=O)CC1=CC=CC=C1
|
|
| MCULE-7859996797 |
0.72 |
C12C(=O)NC(C(NC(CO)C(=O)NC(CC(=O)NC(CC(N)=O)C(=O)NC(CC3C=CC(O)=CC=3)C(=O)NC(CC(=O)N)C(=O)NC(CCC(=O)N)C(=O)N1CCC2)CCCCCCCCCCCC(C)CC)=O)CC(=O)N
|
|
| MCULE-6215640900 |
0.72 |
CCC(C1C=CC=CC=1)(C(NCC(N[C@H](C(=O)O)CC(C)C)=O)=O)CC
|
|
| MCULE-9010851787 |
0.72 |
N12C[C@@H](CC1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)=O)NC(CC1C=CC(=CC=1)CO)=O
|
|
| MCULE-7903396241 |
0.72 |
O=C(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)CC1CCCC1
|
|
| MCULE-5441940017 |
0.72 |
C(N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](CCC(=O)N)C(=O)N[C@H](C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N)CCSC)CC1C=CC=CC=1)(=O)[C@H](C(C)C)NC([C@@H](N)CC(=O)O)=O
|
|
| MCULE-9589455158 |
0.72 |
CC(C(N1CC(CO)(O)CC1)=O)N1CCC(CC2=CC=CC=C2)CC1
|
|
| MCULE-4997665865 |
0.72 |
C(=O)(C(N)CC1=CC=CC=C1)NCC(=O)NCC(O)=O
|
|
| MCULE-4044244677 |
0.72 |
CC1C=CC(CCC(NCC(NC(C(=O)O)C2CC2)=O)=O)=CC=1
|
|
| MCULE-1310725182 |
0.72 |
CC(N(CC(NC(C(=O)O)CC1C=CC=CC=1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-9343338209 |
0.72 |
N1(C[C@H](CC)NC(=O)[C@H](CC2C=CC=CC=2)NC([C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C1)=O)C(CCC1CCN(CC1)C)=O
|
|
| MCULE-8574703718 |
0.72 |
CCC1(C(N2CC(C3=CC=CC=C3)CC2)=O)NCCC1
|
|
| MCULE-1346606673 |
0.72 |
CC(C[C@@H](C(=O)O)NC(CNC(C1(CC1)CC1C=CC=CC=1)=O)=O)C
|
|
| MCULE-4796781716 |
0.72 |
CCN(C([C@H]1N([C@@H](C(NC)=O)CC2C=CC=CC=2)CCC1)=O)CC
|
|
| MCULE-1218989106 |
0.72 |
CC(C(C1=CC=CC=C1)CNC(CN1C(=O)CCCCCC1)=O)(CO)C
|
|
| MCULE-1895724627 |
0.72 |
CC(N(CC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-7460034797 |
0.72 |
CCCC(N1C(C(N2C[C@@H](C3C=CC=CC=3)[C@H](N)C2)=O)CCC1)=O
|
|
| MCULE-9861767464 |
0.72 |
CC1N(C(C2NCCC2)=O)CC(C2C=CC=CC=2)C1
|
|
| MCULE-4207841755 |
0.72 |
CC1C=CC(CCC(NCC(NC2(C(=O)O)CCC2)=O)=O)=CC=1
|
|
| MCULE-2217217705 |
0.72 |
C(=O)(C(C)(C)C)NCC(=O)NC(CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-2759674756 |
0.72 |
O=C(C(NC(C1C2(CCNCC2)C1)=O)CC1C=CC=CC=1)NC1CC1
|
|
| MCULE-1437566252 |
0.72 |
O=C(C12N(C3CC3)CC(C1)C2)N1CC(C2=CC=CC=C2)CC1
|
|
| MCULE-1096547897 |
0.72 |
N1(CCC2C=CC=CC=2)C(=O)CCC1(C)C(NCCCOC)=O
|
|
| MCULE-2752446629 |
0.72 |
CC(C(NCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)=O)(C)C
|
|
| MCULE-9631258095 |
0.72 |
CC(C(CC1C=CC=CC=1)O)NC(C1NCCC1)=O
|
|
| MCULE-3269039279 |
0.72 |
CN(C(CN(C(=O)C)CCC1C=CC=CC=1)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-3946182966 |
0.72 |
CC(CC(N1C(C(N2C[C@@H](C3C=CC=CC=3)[C@H](N)C2)=O)CCC1)=O)(C)C
|
|
| MCULE-6450586655 |
0.72 |
CCC(C1=CC=CC=C1)CNC(C1NC(=O)CC1)=O
|
|
| MCULE-3623731333 |
0.72 |
COCCN1C(CNC(C(CC2C=CC=CC=2)N)=O)CCC1
|
|
| MCULE-9781950385 |
0.72 |
O=C(NC(C(N1CCCC1)=O)CC1C=CC=CC=1)CNCC1CC1
|
|
| MCULE-7188734950 |
0.72 |
CC(N(CC(NC(C(=O)O)CCC(C)(C)C)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-7449539542 |
0.72 |
C(=O)(CN1CCCCC1)NC(CC1=CC=C(C=C1)F)C(O)=O
|
|
| MCULE-5034287340 |
0.72 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NCCN(C(C2CCCC2)=O)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-3900177927 |
0.72 |
CC1N(C(CNC(CCC2C=CC(C)=CC=2)=O)=O)CCC1C(=O)O
|
|
| MCULE-3703825320 |
0.72 |
CCCCC(C(=O)O)NC(CN(C(=O)C)CCC1C=CC=CC=1)=O
|
|
| MCULE-5653395489 |
0.72 |
C1(=O)N(CCCC1(CNCC(=O)N(C)C)O)CCCC1C=CC=CC=1
|
|
| MCULE-4310567806 |
0.72 |
Cl.OC([C@@H]1N(CC(NCCCC2=CC=CC=C2)=O)CCC1)=O
|
|
| MCULE-3227413568 |
0.72 |
CN(C(CCC1=CC(C)=CC(C)=C1)=O)CC(N1CC(C(O)=O)CCC1)=O
|
|
| MCULE-7423804951 |
0.72 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)NCCN(C(CCCNC(C)=O)=O)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-1370440329 |
0.72 |
CN(C(CCC1C=CC2C=CC=CC=2C=1)=O)CC(N1CC(C(=O)O)CCC1)=O
|
|
| MCULE-2542102197 |
0.72 |
OC(CN(C(CN1C(=O)CCCCC1)=O)CCC1=CC=CC=C1)=O
|
|
| MCULE-1389985978 |
0.72 |
COCCC(C(=O)O)NC(CNC(CCC1C=CC(C)=CC=1)=O)=O
|
|
| MCULE-9732376152 |
0.72 |
CC(C(N1C(C(N2C[C@@H](C3C=CC=CC=3)[C@H](N)C2)=O)CCC1)=O)C
|
|
| MCULE-7650640185 |
0.72 |
CC(C1(C(=O)O)CN(C(CNC(CCC2C=CC(C)=CC=2)=O)=O)CC1)C
|
|
| MCULE-2138377244 |
0.72 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(CC(=O)N[C@@H]([C@@H](C)CC)C2=O)C(=O)C1C=CNC=1)O
|
|
| MCULE-6163627484 |
0.72 |
CN(C(CCC1C=CC=C(C)C=1)=O)CC(N1CC(C(=O)O)CCC1)=O
|
|
| MCULE-4921741527 |
0.72 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)C1=CC=C(C(C)=C1)OC)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-2962704870 |
0.72 |
C(=O)(CN1CCC(CC1)C)NC(CC1=CC=C(C=C1)F)C(O)=O
|
|
| MCULE-6913528999 |
0.72 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(CCC(=O)C1C=CC(=C(C)C=1)OCC)=O)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-8075779586 |
0.72 |
CC(COCCC(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)=O)C
|
|
| MCULE-6689497941 |
0.72 |
CC(N1[C@@H](C(NC2=CC=C(CCC(N3CCCC3)=O)C=C2)=O)C[C@@H](O)C1)=O
|
|
| MCULE-2864197799 |
0.72 |
C1(=O)N(CCCC1(CNCC(NC)=O)O)CCCC1=CC=CC=C1
|
|
| MCULE-7895503125 |
0.72 |
C(N1CCC[C@H]1C(=O)N[C@H](C(=O)O)[C@H](O)C)(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC([C@@H](N)CCCNC(N)=N)=O)CC1C=CC(O)=CC=1
|
|
| MCULE-5313089700 |
0.72 |
C1(CCCN(CCCC2C=CC=CC=2)C1=O)(O)CN(C)CC(NC)=O
|
|
| MCULE-5740035592 |
0.72 |
C(=O)(C1(O)CCN(CC1)C)N[C@@H](CC1C=CC(=CC=1)O)C(N)=O
|
|
| MCULE-5408483501 |
0.72 |
CO[C@@H]1CN(C)[C@H](C(NC2(CC3=C(C=CC=C3)C2)C)=O)C1
|
|
| MCULE-9681970530 |
0.72 |
CC(CC1=CC(F)=CC=C1)CC(N1[C@H](C(N)=O)C[C@@H](O)C1)=O
|
|
| MCULE-2244368396 |
0.72 |
CC(NC(C1(N(C)CC(O)C1)C)=O)CC1=CC(Br)=C(F)C=C1
|
|
| MCULE-4937291521 |
0.72 |
COC1C=CC(CCCN(C(C2NCC(O)C2)=O)C)=CC=1
|
|
| MCULE-1190879944 |
0.72 |
OC[C@H]1NC(=O)CN(C(C2(CCCCC2)CC2=CC(F)=CC=C2)=O)C1
|
|
| MCULE-8357890991 |
0.72 |
COC1=CC=C(CCCNC(C2NCC(O)C2)=O)C=C1
|
|
| MCULE-5442866077 |
0.72 |
N1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C(C)C)NC(CN(C(CCC2=CC=CC(OC)=C2)=O)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-6985387642 |
0.72 |
C(=O)([C@@H](N)CC1=CC=CC=C1)N1CCC(CC1)C(=O)N[C@H](C(O)=O)CC(O)=O
|
|
| MCULE-8895331542 |
0.72 |
C(C1C=CC(O)=CC=1)[C@H](N)C(N[C@H](CC(=O)N)C(N[C@@H](C(C)C)C(N[C@@H](C(NCC(N[C@@H](C(N[C@H](CCC(O)=O)C(N[C@H](CO)C(N[C@@H](C(C)C)C(N[C@@H](CCCCN)C(N[C@@H](CCC(O)=O)C(O)=O)=O)=O)=O)=O)=O)[C@@H](C)CC)=O)=O)CC1C=CC(O)=CC=1)=O)=O)=O
|
|
| MCULE-8273864852 |
0.72 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N[C@H]2CCO[C@@H]([C@H]2O)CN(C(=O)[C@@H]2CCC(=O)N2)CC(=O)N[C@H](CC(C)C)C1=O
|
|
| MCULE-5840930331 |
0.72 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N[C@H]2CCO[C@@H]([C@H]2O)CN(C(=O)[C@H]2CCC(=O)N2)CC(=O)N[C@H](CC(C)C)C1=O
|
|
| MCULE-4016829370 |
0.72 |
N12CCC[C@@H]1C(=O)N[C@H](CC(C)C)C(=O)N[C@H]1CCO[C@@H]([C@H]1O)CN(C(=O)[C@@H]1CCC(=O)N1)CC(=O)N[C@@H](CC1C=CC=CC=1)C2=O
|
|
| MCULE-4325334238 |
0.72 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N[C@H]2CCO[C@@H]([C@H]2O)CN(C(C2CCOCC2)=O)CC(=O)N[C@H](CC(C)C)C1=O
|
|
| MCULE-7397414230 |
0.72 |
N12CCC[C@@H]1C(=O)N[C@H](CC(C)C)C(=O)N[C@H]1CCO[C@@H]([C@H]1O)CN(C(=O)CCOC)CC(=O)N[C@@H](CC1=CC=CC=C1)C2=O
|
|
| MCULE-2436392663 |
0.72 |
CC(N1C(C(NCC2(C3=CC=CC=C3)CC2)=O)CCC1)=O
|
|
| MCULE-7283848682 |
0.72 |
CC([C@@H](C(NCC(N1C(C)C(C2C=CC=CC=2)CC1)=O)=O)N)C
|
|
| MCULE-9186206982 |
0.72 |
CC1N(CC(NCC(=O)O)=O)CCC1C1C=CC=CC=1
|
|
| MCULE-1928707464 |
0.72 |
O=C(C12NCC(C1)C2)N1CC(C2=CC=CC=C2)CC1
|
|
| MCULE-2429143733 |
0.72 |
O=C(C1NCCC1)NC1C(C2C=CC=CC=2)C1
|
|
| MCULE-8662879505 |
0.72 |
CC([C@@H](C(NCC(NC(C(N1CCCC1)=O)CC1C=CC=CC=1)=O)=O)N)C
|
|
| MCULE-8478950191 |
0.72 |
COC(C1C(C2=CC=CC=C2)CN(C(C2NC(=O)CCCC2)=O)C1)=O
|
|
| MCULE-7810682960 |
0.72 |
OC([C@H]1[C@@H](C2C=CC=CC=2)CN(C(C2N(CC3C=CC=CC=3)CCC2)=O)C1)=O
|
|
| MCULE-7650629220 |
0.72 |
N1(CCCC2=CC=CC=C2)C(=O)CCC1(C)C(NCCOC)=O
|
|
| MCULE-3182638607 |
0.72 |
C(O)(=O)[C@@H](NC(=O)[C@@H](N)CC(C)C)CC1=CC=C(O)C=C1
|
|
| MCULE-4675696185 |
0.72 |
O=C(C1CNCCC1)NC(C(N1CCCC1)=O)CC1=CC=CC=C1
|
|
| MCULE-8359604881 |
0.72 |
CC1(N(C(CNC(CC2=C3C=CC=CC3=CC=C2)=O)=O)CC(O)C1)CO
|
|
| MCULE-7700655555 |
0.72 |
N1(CCCNC(=O)[C@H](CC2=CC=CC=C2)NC(CN(C)C(=O)[C@H](C(C)C)NC(=O)[C@H]1C)=O)C(=O)[C@H]1CCC(=O)N1
|
|
| MCULE-3905813917 |
0.72 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(CC1CC(C)(C)NC(C)(C)C1)=O)C
|
|
| MCULE-5257632778 |
0.72 |
CN(C(CCC1C=CC=CC=1)=O)CC(N1CC(C(=O)O)CCC1)=O
|
|
| MCULE-5118631000 |
0.72 |
COC(C(C)(C)C)CNC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O
|
|
| MCULE-1811837492 |
0.72 |
CN1C(C(NC2CCC(C3=CC=CC=C3)(C)CC2)=O)(C)CC(O)C1
|
|
| MCULE-1761490607 |
0.72 |
OC[C@@H]1N(C(C2CC3=C(C=CC=C3)C2)=O)C[C@H]2N(CCC2)C1
|
|
| MCULE-7664473319 |
0.72 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(CCC(F)(F)F)=O)C
|
|
| MCULE-7259828836 |
0.72 |
O=C([C@H](CC1C=CC(O)=CC=1)NC(=O)[C@H](CC(C)C)N)O
|
|
| MCULE-8186915666 |
0.72 |
COC(C(C)C)CNC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O
|
|
| MCULE-6310948253 |
0.72 |
CC(C(C1C=CC=CC=1)CC(N(CC(N1CC(C(=O)O)CCC1)=O)C)=O)C
|
|
| MCULE-9659112352 |
0.72 |
CN(C(CC(C1C=CC=CC=1)(C)C)=O)CC(N1CC(C(=O)O)CCC1)=O
|
|
| MCULE-7060315948 |
0.72 |
NC(C(NC(C1C(C(=O)O)C1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-1206994770 |
0.72 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(=O)CN1CCCN(C)CC1)C
|
|
| MCULE-6845768783 |
0.72 |
CC(C1C=CC=CC=1)CC(N(CC(N1CC(C(=O)O)CCC1)=O)C)=O
|
|
| MCULE-9721609734 |
0.72 |
CC1C=CC(CCC(NCC(NC(C(=O)O)CC2CC2)=O)=O)=CC=1
|
|
| MCULE-7675306054 |
0.72 |
C(C1C=CC(O)=CC=1)C(C(O)=O)NC(=O)C(N)CC(C)C
|
|
| MCULE-6306464056 |
0.72 |
CC1C=CC(CCC2CCN(C(C3NCC(O)C3)=O)CC2)=CC=1
|
|
| MCULE-6527239881 |
0.72 |
CN(C(C(CC1C=CC=CC=1)(C)C)=O)CC(N1CC(C(=O)O)CCC1)=O
|
|
| MCULE-5722739353 |
0.72 |
[C@@H](C(=O)O)(CC1=CC=C(O)C=C1)NC(=O)[C@@H](N)[C@@H](C)CC
|
|
| MCULE-8772512364 |
0.72 |
CC(C[C@@H](C(=O)O)NC(CNC(C(C1C=CC=CC=1)C1CC1)=O)=O)C
|
|
| MCULE-1045970317 |
0.72 |
CC(C[C@@H](C(=O)O)NC(CNC(C1(C2C=CC=CC=2)CCC1)=O)=O)C
|
|
| MCULE-7076643589 |
0.72 |
CCC(C1=CC=CC=C1)CC(N(CC(N1CC(C(O)=O)CCC1)=O)C)=O
|
|
| MCULE-3445181142 |
0.72 |
CC1C=CC(CCC(NCC(NC2(C(=O)O)CCCC2)=O)=O)=CC=1
|
|
| MCULE-6081239519 |
0.72 |
CN1C(C(NCCC2CC3=C(C=CC=C3)C2)=O)(C)CC(O)C1
|
|
| MCULE-3626080982 |
0.72 |
CC(OCCC(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)=O)C
|
|
| MCULE-8619757241 |
0.72 |
N1(CCNC(=O)C1CCO)C(=O)C1CC2=C(C=CC=C2)C1
|
|
| MCULE-1684231386 |
0.72 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(CC[C@@H]1CCCN2CCCC[C@@]21[H])=O)C
|
|
| MCULE-6549444071 |
0.72 |
C1C2C(CC1N1CC3(C1)N1C[C@@H](C[C@H]1C(=O)N(CC(=O)OC)C3=O)O)=CC=CC=2
|
|
| MCULE-6850816808 |
0.72 |
OC([C@H](NC(CN1C(=O)C2C(C3OC2CC3)C1=O)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-6813917065 |
0.72 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)CN1CCC3C(=CC=CC=3)C1)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
|
|
| MCULE-9042015160 |
0.72 |
CN1C(C(N2CCC(C3=C(Cl)C=CC=C3)(O)CC2)=O)(C)CC(O)C1
|
|
| MCULE-5904338544 |
0.72 |
CN1C(=O)CCC1C(N1C(C(C2=CC=CC=C2)O)CCCC1)=O
|
|
| MCULE-3103346385 |
0.72 |
CCC(C1=CC=C(CNC([C@@H]2N(C(C)=O)C[C@H](O)C2)=O)C=C1)(C)C
|
|
| MCULE-1854309598 |
0.72 |
N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1C=CC(=CC=1)OC)C(=O)C1(CO)CC1
|
|
| MCULE-4738780687 |
0.72 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(C(=O)CCSC)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-4928977875 |
0.72 |
CCCC(C(N(CC(=O)O)C)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-3361030880 |
0.72 |
CCCC(C(N(CC(=O)O)CCC)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-3171808181 |
0.72 |
CC1C(C)N(C([C@H](CC2=CC=CC=C2)O)=O)C(C)C(=O)N1
|
|
| MCULE-5319434627 |
0.72 |
CCCC(C(N(CC(=O)O)CC)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-1071840863 |
0.72 |
OC([C@H]1N(CC(NCCC2=CC=CC=C2)=O)CCC1)=O
|
|
| MCULE-4851052638 |
0.72 |
CCCC(C(N1CC(C2=CC=CC=C2)(CO)CC1)=O)O
|
|
| MCULE-7675847563 |
0.72 |
CCCC(C(NCC(=O)O)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-5571505972 |
0.72 |
C(CC(N)=O)[C@H](C(N[C@@H](C(N[C@H](C(N[C@H](CCCCN)C(N[C@@H](C(N[C@H](CC(=O)N)C(N[C@@H](CO)C(N[C@@H](CCCCN)C(N[C@@H](C(N[C@H](C(NCC(N[C@H](C(N[C@@H]([C@@H](O)C)C(N[C@@H](CCC(O)=O)C(N[C@H](CC(C)C)C(O)=O)=O)=O)=O)[C@H](C)CC)=O)=O)[C@H](C)CC)=O)CC1C=CC=CC=1)=O)=O)=O)=O)C)=O)=O)[C@H](C)CC)=O)CC1C=CC(O)=CC=1)=O)N
|
|
| MCULE-1943227414 |
0.72 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)CN1CCN(CC1)C1=NC=CC=N1)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
|
|
| MCULE-5012319571 |
0.72 |
C(C1C=CC(O)=CC=1)[C@H](N)C(N[C@H](CC(=O)N)C(N[C@@H](C(C)C)C(N[C@@H](C(NCC(N[C@@H](C(N[C@H](CCC(O)=O)C(N[C@H](CO)C(N[C@@H](C(C)C)C(N[C@H](CCCCN)C(N[C@H](C(O)=O)[C@@H](C)CC)=O)=O)=O)=O)=O)[C@@H](C)CC)=O)=O)CC1C=CC(O)=CC=1)=O)=O)=O
|
|
| MCULE-3481662527 |
0.72 |
C(N)C(N[C@H](C(N[C@H](C(N[C@H](CO)C(N[C@H](CC(C)C)C(N[C@H](C(N[C@@H](C(N[C@H](CO)C(NCC(NCC(N[C@H](CC(C)C)C(N)=O)=O)=O)=O)=O)CC1C=CC=CC=1)=O)C)=O)=O)=O)CC(O)=O)=O)CCSC)=O
|
|
| MCULE-2395794907 |
0.72 |
N1(CC[C@]([C@H](N2CCCC2)C1)(O)C1=CC=CC=C1)C(C1CCCCC1)=O
|
|
| MCULE-4425749245 |
0.72 |
C1(N(C)CCC2=CC=CC=C2)(CC2C(=CC=CC=2)C1)C(=O)NCC(CO)O
|
|
| MCULE-3178357145 |
0.72 |
C(=O)(N(C)CC1CCN(CC1)CCC1C=CC=CC=1F)[C@H]1C[C@H](CN1)O
|
|
| MCULE-8955339363 |
0.72 |
C1(N(C)CCC2C=CC=CC=2)(CC2C(=CC=CC=2)C1)C(=O)N(C)CC(CO)O
|
|
| MCULE-3848913112 |
0.72 |
N1(CCC(O)(C2C=CC=CC=2C)C1)C(=O)CN1CCC(CC1)C1=CC=CC=C1
|
|
| MCULE-9165662232 |
0.72 |
CN1C(C(NCCC2=CC(Cl)=CC(Cl)=C2)=O)(C)CC(O)C1
|
|
| MCULE-3135443968 |
0.72 |
C(N)(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H]([C@H](O)C)N.C(O)(=O)C(F)(F)F
|
|
| MCULE-7743890963 |
0.72 |
CO[C@@H]1CN(C)[C@H](C(NC2(CC3=C(C=CC=C3)C2)CO)=O)C1
|
|
| MCULE-5369034820 |
0.72 |
N1C(C(NC(=O)C1C(C)C)CC1C=CC=CC=1)=O
|
|
| MCULE-7150286642 |
0.72 |
N12CCC[C@@]1([H])C(=O)N(CC2=O)CCC1C=CC=CC=1
|
|
| MCULE-2296104813 |
0.72 |
N1C(CC2=CC=CC=C2)C(=O)NC(CC2=CC=CC=C2)C1=O
|
|
| MCULE-4521818975 |
0.72 |
C1(CC2C=CC=CC=2)C(=O)NC(C)C(=O)N1
|
|
| MCULE-3407577373 |
0.72 |
CCN(C(C1N(C(CCC2=CC=CC=C2)=O)CCC1)=O)CC
|
|
| MCULE-2569731693 |
0.72 |
CC(CC(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)=O)C
|
|
| MCULE-3561487521 |
0.72 |
O=C(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)CCC1=CC=CC=C1
|
|
| MolPort-046-570-441 |
0.72 |
COC1=CC=C(C[C@@H]2NC(=O)[C@H](CC(C)C)NC(=O)CN(C[C@@H](NC(=O)[C@@H](C)NC2=O)C(C)C)C(=O)CCO)C=C1
|
|
| MolPort-035-814-000 |
0.72 |
CC(C)[C@H]1CC[C@@H](CC1)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N1CCOCC1
|
|
| MolPort-035-860-075 |
0.72 |
OC1(CCN(C1)C(=O)CN1C(=O)CNC1=O)C1=CC=CC=C1
|
|
| MolPort-000-810-532 |
0.72 |
Cl.NC(=O)CC[C@H](NC(=O)C1(CCN(CC1)C(=O)[C@@H]1CCCN1)C1=CC=CC=C1)C(O)=O
|
|
| MolPort-021-745-512 |
0.72 |
CC(C)[C@H]1CC[C@@H](CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N1CCOCC1
|
|
| MolPort-023-308-746 |
0.72 |
CC(C)C1CCC(CC1)C(=O)NC(CC1=CC=CC=C1)C(=O)N1CCOCC1
|
|
| MolPort-039-293-649 |
0.72 |
OC(CNC(=O)C1CC(O)CN1)C1=CC=CC=C1Cl
|
|
| MolPort-044-367-814 |
0.72 |
CNC(=O)[C@@H]1C[C@@H](O)CN1C1CCN(CC1)C(=O)CC1=C(C)C=CC=C1
|
|
| MolPort-045-943-086 |
0.72 |
C[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)COC2=CC=C(C[C@H](NC1=O)C(=O)N1CCC(O)(CC1)C1=CC=CC=C1)C=C2
|
|
| MolPort-046-418-745 |
0.72 |
NCCCC[C@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](N)CCCNC(N)=N)C(=O)N1CCC[C@H]1C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CCC(N)=O)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCC(O)=O
|
|
| MolPort-044-858-263 |
0.72 |
CO[C@H]1C[C@H](N(C1)C(=O)CC1=CC=CC=C1O)C(=O)N1CCCC1
|
|
| MolPort-045-936-111 |
0.72 |
C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCC2=CC=CC=C2)NC(=O)COC2=CC=C(C[C@H](NC1=O)C(=O)NCCCO)C=C2
|
|
| MolPort-046-757-056 |
0.72 |
CC(C)C[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@H](CC2=CC=C(OCCNC(=O)[C@H]3CCCN3C1=O)C=C2)NC(C)=O
|
|
| MolPort-045-916-262 |
0.72 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)CN1C=C(C)C=N1
|
|
| MolPort-045-933-887 |
0.72 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)C1=CC(O)=C(OC)C=C1
|
|
| MolPort-030-011-849 |
0.72 |
CCCC(NC(=O)CC1=CC=CC=C1)C(=O)NC[C@H](C)O
|
|
| MolPort-028-737-334 |
0.72 |
CC(C)N1CCC(CC(=O)N[C@@H](CC2=CC=CC=C2)C(O)=O)CC1
|
|
| MolPort-044-622-799 |
0.72 |
Cl.CC(C)[C@@H](N)C(=O)N[C@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-020-064-533 |
0.72 |
Cl.CC(C)C(N)C(=O)NC(CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-002-200-186 |
0.72 |
CC(C)CC(NC(=O)C(CC1=CC=CC=C1)NC(=O)C1=CC=CC=C1)C(O)=O
|
|
| MolPort-044-708-652 |
0.72 |
OC1=CC=C(C[C@H]2NC(=O)C3(CCOCC3)NC2=O)C=C1
|
|
| MolPort-039-059-404 |
0.72 |
OC[C@H](CC1=CC=CC=C1)NC(=O)CN1C(=O)CC2(CCCC2)C1=O
|
|
| MolPort-039-167-646 |
0.72 |
CO[C@H]1C[C@H](N(C)C1)C(=O)NCC1(CC1)C1=CC=CC(F)=C1
|
|
| MolPort-021-745-594 |
0.72 |
CCCCCC(=O)N1CCC[C@@H]1C(=O)NC(CC1=CC=C(O)C=C1)C(N)=O
|
|
| MolPort-045-955-595 |
0.72 |
OC1=CC=C(C[C@@H]2NC(=O)C3(CCOCC3)NC2=O)C=C1
|
|
| MolPort-035-789-701 |
0.72 |
CN[C@@H](C)C(=O)N[C@@H](C1CCCCC1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C1=CC=CC=C1)C1=CC=CC=C1)C(=O)NCCCCCCNC(=O)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)[C@@H](NC(=O)[C@H](C)NC)C1CCCCC1)C(C1=CC=CC=C1)C1=CC=CC=C1
|
|
| MolPort-046-495-073 |
0.72 |
CC(CC(=O)NC1CCCCN(CC(O)=O)C1=O)C1=CC=CC=C1C
|
|
| MolPort-046-617-076 |
0.72 |
CN(C)C(=O)[C@@H]1C[C@@H](CN1CCCC1=CC=CC=C1)OC1CCN(CC1)C(C)=O
|
|
| MolPort-039-164-919 |
0.72 |
CO[C@H]1C[C@H](N(C)C1)C(=O)NCC1(CC1)C1=CC=C(Cl)C=C1
|
|
| MolPort-002-516-430 |
0.72 |
CC(C)C[C@@H](NC(=O)[C@@H](N)CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O
|
|
| MolPort-005-127-864 |
0.72 |
CN(C)C1(CC2=CC=CC=C2C1)C(=O)N1CC[C@H](O)C1
|
|
| MolPort-045-937-936 |
0.72 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2)NC1=O)[C@@H](C)O)C(=O)CC1=CC=C(F)C(F)=C1
|
|
| MolPort-008-818-520 |
0.72 |
CC(C)CC(NC(=O)C(N)CC1=CC=CC=C1)C(=O)NC(CCCNC(N)=N)C(O)=O
|
|
| MolPort-002-529-681 |
0.72 |
N[C@@H](CC1=CC=CC=C1)C(=O)N1CCC(CC1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
|
|
| MolPort-002-512-207 |
0.72 |
CC(C)C[C@@H](NC(=O)[C@H](N)CC1=CC=CC=C1)C(=O)N[C@H](CCCNC(N)=N)C(O)=O
|
|
| MolPort-008-346-849 |
0.72 |
CC(C)C[C@H](NC(=O)[C@H](N)CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(N)=N)C(O)=O
|
|
| MolPort-039-151-099 |
0.72 |
CN(CC(O)=O)C1CN(C[C@H]1O)C(=O)C1CC1C1=CC=CC=C1C
|
|
| MolPort-042-665-004 |
0.72 |
OCC(CC1=CC=CC=C1)NC(=O)CN1C(=O)CC2(CCCC2)C1=O
|
|
| MolPort-044-560-279 |
0.72 |
OC(=O)C(F)(F)F.CC(C)[C@@H]1N(C)C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CC(O)=O)NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC1=O
|
|
| MolPort-000-819-942 |
0.72 |
CC(C)(C)OC(=O)N1CCC(CC1)(C(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O)C1=CC=CC=C1
|
|
| MolPort-046-683-514 |
0.72 |
OC(=O)C(F)(F)F.CC(C)[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CC(O)=O)NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC1=O
|
|
| MolPort-046-578-576 |
0.72 |
COCC(=O)N1C[C@H]2OCC[C@H](NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@H](C)N(C)C(=O)[C@@H]3CCCN3C(=O)C1)[C@@H]2O
|
|
| MolPort-020-136-872 |
0.72 |
CCCC(=O)N1CCCC1C(=O)N1CCC(C1)C1=CC=CC=C1C
|
|
| MolPort-045-941-258 |
0.72 |
CC(C)C[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](C)N(C)C1=O)C(=O)CCC(=O)N(C)C
|
|
| MolPort-045-916-400 |
0.72 |
CC(C)C[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](C)N(C)C1=O)C(=O)C1CCN(CC(N)=O)CC1
|
|
| MolPort-027-697-774 |
0.72 |
O=C(NC1CC1C1=CC=CC=C1)C1CCCN1C(=O)C1CCCCC1
|
|
| MolPort-046-568-705 |
0.72 |
CC[C@H]1CN(CC(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N1)C(=O)C1CCNCC1
|
|
| MolPort-002-522-292 |
0.72 |
CC(C)[C@H](NC(=O)C1CCN(CC1)C(=O)[C@@H](N)CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-001-740-102 |
0.72 |
CC(C)CCCCCCCCCC1CC(=O)NC(CC(N)=O)C(=O)NC(CC2=CC=C(O)C=C2)C(=O)NC(CC(N)=O)C(=O)NC(CCC(N)=O)C(=O)N2CCCC2C(=O)NC(CC(N)=O)C(=O)NC(CO)C(=O)N1
|
|
| MolPort-000-829-192 |
0.72 |
Cl.OC(=O)CCCNC(=O)C[C@@H](CNC(=O)[C@@H]1CCCN1)C1=CC=C(Cl)C=C1
|
|
| MolPort-001-739-581 |
0.72 |
CCCCCCCCCCCC1CC(=O)NC(CC(N)=O)C(=O)NC(CC2=CC=C(O)C=C2)C(=O)NC(CC(N)=O)C(=O)NC(CCC(N)=O)C(=O)N2CCCC2C(=O)NC(CC(N)=O)C(=O)NC(CO)C(=O)N1
|
|
| MolPort-046-788-370 |
0.72 |
CN[C@@H](C)C(=O)N[C@@H](C1CCCCC1)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C1=CC=CC=C1)C1=CC=CC=C1)C(=O)OC
|
|
| MolPort-000-783-748 |
0.72 |
[Cl-].[NH3+][C@@H](CC1=CC=CC=C1)C(=O)N1CCC(CC1)C(=O)N[C@@H](CC(O)=O)C(O)=O
|
|
| MolPort-045-944-190 |
0.72 |
CC(C)C[C@@H]1NC(=O)[C@@H]2CCC[C@H]2NC(=O)[C@H](C)NC(=O)C2C[C@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CC1=CC=C(CO)C=C1
|
|
| MolPort-006-668-212 |
0.72 |
CC(C)CCCCCCCCCCC1CC(=O)NC(CC(N)=O)C(=O)NC(CC2=CC=C(O)C=C2)C(=O)NC(CC(N)=O)C(=O)NC(CCC(N)=O)C(=O)N2CCCC2C(=O)NC(CC(N)=O)C(=O)NC(CO)C(=O)N1
|
|
| MolPort-029-943-151 |
0.72 |
CCC(C)CCCCCCCCCCC1CC(=O)NC(CC(N)=O)C(=O)NC(CC2=CC=C(O)C=C2)C(=O)NC(CC(N)=O)C(=O)NC(CCC(N)=O)C(=O)N2CCCC2C(=O)NC(CC(N)=O)C(=O)NC(CO)C(=O)N1
|
|
| MolPort-039-345-910 |
0.72 |
CC(C)C1CCC(CC1)C(=O)NC(CC1=CC=CC=C1)C(=O)NCC1CCOCC1
|
|
| MolPort-044-450-193 |
0.72 |
CO[C@@H]1CN[C@@H](C1)C(=O)N1CCC(CC1)C1=CC=CC=C1C
|
|
| MolPort-021-745-709 |
0.72 |
CC(C)[C@H]1CC[C@@H](CC1)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)NCC1CCOCC1
|
|
| MolPort-019-815-232 |
0.72 |
CN1CCC(CC1)(C(=O)N1CCN(C)C(C1)C(O)=O)C1=CC=CC=C1
|
|
| MolPort-046-703-151 |
0.72 |
NCCCCC(NC(=O)C1CCCN1C(=O)C(N)CCCN=C(N)N)C(=O)N1CCCC1C(=O)NC(CCC(N)=O)C(=O)NC(CCC(N)=O)C(=O)NC(CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-044-476-270 |
0.72 |
OC1CCCCN(CC(=O)NCC2(CC2)C2=CC=C(F)C=C2)C1=O
|
|
| MolPort-042-675-521 |
0.72 |
CCC(C)CCCCCCCCCCCC1CC(=O)NC(CC(N)=O)C(=O)NC(CC2=CC=C(O)C=C2)C(=O)NC(CC(N)=O)C(=O)NC(CCC(N)=O)C(=O)N2CCCC2C(=O)NC(CC(N)=O)C(=O)NC(CO)C(=O)N1
|
|
| MolPort-039-235-327 |
0.72 |
Cl.COC1=CC=C(CCCNC(=O)C2CC(O)CN2)C=C1
|
|
| MolPort-027-857-853 |
0.72 |
CC1=C(C=CC=C1)[C@@H]1CN(C[C@H]1C(O)=O)C(=O)CN1CCCCCC1=O
|
|
| MolPort-005-041-209 |
0.72 |
OC[C@@H]1CCCN1C(=O)C1(CC2=CC=CC=C2C1)N1CCCCC1
|
|
| MolPort-046-683-608 |
0.72 |
OC(=O)C(F)(F)F.C[C@H](N)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N1CCC[C@H]1C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC1=CC=CC=C1)C(N)=O
|
|
| MolPort-044-430-585 |
0.72 |
CC(C)[C@H]1CC[C@@H](CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCC1CCOCC1
|
|
| MolPort-039-167-273 |
0.72 |
CO[C@H]1C[C@H](N(C1)C(=O)CCC1=CC=C(OC)C=C1)C(N)=O
|
|
| MolPort-002-670-184 |
0.72 |
OC(=O)CCCNC(=O)C[C@@H](CNC(=O)[C@@H]1CCCN1)C1=CC=C(Cl)C=C1
|
|
| MolPort-009-758-446 |
0.72 |
Cl.N[C@@H](CC1=CC=CC=C1)C(=O)N1CCC(CC1)C(=O)N[C@@H](CC(O)=O)C(O)=O
|
|
| MolPort-035-765-957 |
0.72 |
CC[C@H](C)[C@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(O)=O
|
|
| MolPort-039-112-226 |
0.72 |
CN1CCN([C@H](C1)C1=CC=CC=C1)C(=O)[C@@H]1C[C@@H](O)CN1
|
|
| MolPort-046-573-518 |
0.72 |
CC(C)C[C@H]1NC(=O)CNC[C@H]2OCC[C@H](NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@H](C)N(C)C1=O)[C@@H]2O
|
|
| MolPort-039-173-156 |
0.72 |
CO[C@H]1C[C@H](N(C)C1)C(=O)NC1(C)CC2=CC=CC=C2C1
|
|
| MolPort-020-104-542 |
0.72 |
CCC(CNC(=O)C1CCC(=O)N1)C1=CC=CC=C1
|
|
| MolPort-020-134-435 |
0.72 |
CC(C)COCCC(=O)NC(CC1=CC=CC=C1)C(=O)N1CCCC1
|
|
| MolPort-019-822-801 |
0.72 |
CNC(=O)CNCC1(O)CCCN(CCCC2=CC=CC=C2)C1=O
|
|
| MolPort-019-820-886 |
0.72 |
CN(C)C(=O)CNCC1(O)CCCN(CCCC2=CC=CC=C2)C1=O
|
|
| MolPort-045-932-119 |
0.72 |
COC1=CC=CC(CCC(=O)N2CCNC(=O)[C@@H](NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@H](NC(=O)C2)C(C)C)[C@@H](C)O)=C1
|
|
| MolPort-019-804-172 |
0.72 |
CNC(=O)CN(C)CC1(O)CCCN(CCCC2=CC=CC=C2)C1=O
|
|
| MolPort-028-609-460 |
0.72 |
CCNC(=O)[C@@H]1CCCN1[C@H](CC1=CC=CC=C1)C(=O)NC
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| MolPort-044-440-842 |
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OC[C@@H]1CN(CC(=O)N1)C(=O)C1(CC2=CC=CC(F)=C2)CCCCC1
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|
| MolPort-046-774-550 |
0.72 |
Cl.CCC[C@H](N)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(O)=O
|
|
| MolPort-029-943-870 |
0.72 |
CCN(CC)C(=O)[C@@H]1CCCN1[C@H](CC1=CC=CC=C1)C(=O)NC
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|
| MolPort-002-547-576 |
0.72 |
CC(C)(C)C(=O)NCC(=O)NC(CC1=CC=CC=C1)C(O)=O
|
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| MolPort-023-276-156 |
0.72 |
CC[C@H](C)[C@H](NC(=O)CNC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(C)C)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CO)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(O)=O)C(O)=O
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| MolPort-019-939-122 |
0.72 |
CC[C@H](C)[C@@H](NC(=O)CNC(=O)[C@@H](CC1=CC=C(O)C=C1)NC(=O)[C@@H](NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(C)C)C(=O)N[C@H](CCC(O)=O)C(=O)N[C@H](CO)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CCC(O)=O)C(O)=O
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0.71 |
O=C(CCC1=CC=CC=C1)N1C[C@H](C[C@H]1C(=O)NC1CC1)OC1=CC=CC=C1
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0.71 |
Cl.OC(=O)[C@@H]1CCCN1CC(=O)NCCC1=CC=CC=C1
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0.71 |
CC[C@H](C)[C@H](NC(=O)[C@H](C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](C)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@@H](N)[C@@H](C)O)[C@@H](C)CC)[C@@H](C)O)C(N)=O
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| MolPort-045-932-010 |
0.71 |
C[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)COC2=CC=C(C[C@H](NC1=O)C(O)=O)C=C2
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| MolPort-020-201-741 |
0.71 |
CC(C)(CC(=O)N1CCNC(C1)C(O)=O)C1=CC=CC=C1
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| MolPort-005-581-452 |
0.71 |
OC1CCC(CC1)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(C1=CC=CC=C1)C1=CC=CC=C1
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0.71 |
NCCCC[C@H](N[C@@H](CCC1=CC=CC=C1)C(=O)NCCCC[C@H](N[C@@H](CCC1=CC=CC=C1)C(O)=O)C(=O)N1CCC[C@H]1C(O)=O)C(=O)N1CCC[C@H]1C(O)=O
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| MolPort-019-939-125 |
0.71 |
CC[C@@H](C)[C@@H](NC(=O)[C@H](C)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)CNC(=O)[C@H](CO)NC(=O)[C@H](C)NC(=O)[C@@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@@H](CC(O)=O)NC(=O)[C@@H](C)NC(=O)[C@@H](CC1=CC=C(O)C=C1)NC(=O)[C@H](N)[C@H](C)O)[C@H](C)CC)[C@H](C)O)C(N)=O
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| MolPort-044-468-346 |
0.71 |
CC1=CC=CC=C1C1(CNC(=O)CN2CCCCC(O)C2=O)CC1
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|
| MolPort-044-692-572 |
0.71 |
CN(C)[C@@H](CC1=CC=CC=C1)C(=O)NCCC1(O)CCCC1
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|
| MolPort-019-672-547 |
0.71 |
O=C(CN1CCC(C1)C1=CC=CC=C1)NC1CCCCNC1=O
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|
| MolPort-046-578-566 |
0.71 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC1=O)NC(=O)C1=CC=CC2=NC=CC=C12
|
|
| MolPort-045-915-415 |
0.71 |
C[C@@H](N)C(=O)N1CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](CC2=CNC3=CC=CC=C23)NC(=O)C1
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|
| MolPort-045-938-679 |
0.71 |
CC(=O)NCC(=O)N1CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](CC2=CNC3=CC=CC=C23)NC(=O)C1
|
|
| MolPort-045-915-849 |
0.71 |
NCC(=O)N1CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](CC2=CNC3=CC=CC=C23)NC(=O)C1
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|
| MolPort-045-931-715 |
0.71 |
CC(=O)N1CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](CC2=CNC3=CC=CC=C23)NC(=O)C1
|
|
| MolPort-045-934-953 |
0.71 |
CC(C)(C)C(=O)N1CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](CC2=CNC3=CC=CC=C23)NC(=O)C1
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|
| MolPort-045-932-770 |
0.71 |
CCC(CC)C(=O)N1CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](CC2=CNC3=CC=CC=C23)NC(=O)C1
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|
| MolPort-046-576-433 |
0.71 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC1=O)NC(=O)C1=CNC=C1
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|
| MolPort-000-806-510 |
0.71 |
[Cl-].CC(C)[C@@H]([NH3+])C(=O)NC[C@H]1CC[C@@H](CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
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|
| MolPort-028-734-440 |
0.71 |
CN1CC2(CCN(CC2)C(=O)CN2CC(CC2=O)C2=CC=CC=C2)CCC1=O
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|
| MolPort-000-802-552 |
0.71 |
[Cl-].CCC(C)[C@H]([NH3+])C(=O)NC[C@H]1CC[C@@H](CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
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|
| MolPort-009-758-454 |
0.71 |
Cl.CC(C)C[C@H](N)C(=O)N1CCC(CC1)C(=O)N[C@H](CC1=CC=CC=C1)C(O)=O
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|
| MolPort-000-803-405 |
0.71 |
[Cl-].CCC(C)[C@H]([NH3+])C(=O)N1CCC(CC1)C(=O)N[C@H](CC1=CC=CC=C1)C(O)=O
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|
| MolPort-000-812-221 |
0.71 |
[Cl-].CC(C)C[C@H]([NH3+])C(=O)N1CCC(CC1)C(=O)N[C@H](CC1=CC=CC=C1)C(O)=O
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|
| MolPort-002-246-844 |
0.71 |
OC(=O)C(CC1=CC=CC=C1)NC(=O)C1CCCN1C(=O)COC1=CC=CC=C1
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|
| MolPort-045-934-912 |
0.71 |
C[C@@H]1NC(=O)[C@@H]2CCCN2C(=O)[C@H](CCC2=CC=CC=C2)NC(=O)COC2=CC=C(C[C@H](NC1=O)C(=O)N1CCC(O)CC1)C=C2
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| MolPort-028-960-074 |
0.71 |
CC(C)(C)OC(=O)N[C@H](CC1=CC=CC=C1)C(=O)N1CCC[C@H]1C(O)=O
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|
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0.71 |
CC(C)(C)OC(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N1CCC[C@H]1C(O)=O
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0.71 |
Cl.CCC(C)[C@H](N)C(=O)N1CCC(CC1)C(=O)N[C@H](CC1=CC=CC=C1)C(O)=O
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0.71 |
[Cl-].CC(C)[C@H]([NH3+])C(=O)NC[C@H]1CC[C@@H](CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
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| MolPort-039-293-689 |
0.71 |
CN(C)C(CNC(=O)C1CC(O)CN1)C1=CC=C(F)C=C1
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| MolPort-009-757-415 |
0.71 |
Cl.CC(C)CC(NC(=O)[C@H]1CCCN1C(=O)CNC(=O)[C@H](C)NC(=O)[C@H](N)CC1=CC=C(O)C=C1)C(=O)NCC(N)=O
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| MolPort-046-567-419 |
0.71 |
CC(C)[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](C)NC(=O)[C@H](CC2=CC=C(OC[C@H](CC3=CC=CC=C3)NC1=O)C=C2)NC(=O)[C@H]1CCC(=O)N1)[C@@H](C)O
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| MolPort-003-981-156 |
0.71 |
N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC1=CC=C(O)C=C1)C(O)=O
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|
| MolPort-009-584-057 |
0.71 |
CN(CC(=O)NC(CC1=CC=CC=C1)C(=O)N1CCCC1)C(C)=O
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|
| MolPort-046-567-359 |
0.71 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)C1=CNN=C1
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| MolPort-007-892-364 |
0.71 |
COCCNC(=O)C1(C)CCC(=O)N1CCC1=CC=CC=C1
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| MolPort-046-567-189 |
0.71 |
CC(C)[C@H]1NC(=O)[C@@H](NC(=O)[C@@H](C)NC(=O)[C@H](CC2=CC=C(OC[C@H](CC3=CC=CC=C3)NC1=O)C=C2)NC(=O)[C@@H]1CCC(=O)N1)[C@@H](C)O
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| MolPort-009-758-532 |
0.71 |
Cl.C[C@@H](N)C(=O)NC[C@H]1CC[C@@H](CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
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| MolPort-046-754-727 |
0.71 |
CC(C)C[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@H](CC2=CC=C(OCCNC(=O)[C@H]3CCCN3C1=O)C=C2)NC(=O)C1CCOCC1
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| MolPort-027-811-513 |
0.71 |
CNCC(=O)N1C[C@H]([C@@H](C1)C1=CC=CC=C1)C(O)=O
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| MolPort-046-756-332 |
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CC(C)C[C@@H]1NC(=O)[C@@H](C)NC(=O)[C@H](CC2=CC=C(OCCNC(=O)[C@H]3CCCN3C1=O)C=C2)NC(=O)C1CC1
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| MolPort-046-139-225 |
0.71 |
CCOCC1CCN(C1)C(=O)C1NCCCC1C1=CC=CC=C1
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| MolPort-005-149-971 |
0.71 |
COCC(O)CNC(=O)C1(CC2=CC=CC=C2C1)N1CCCCC1
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|
| MolPort-012-238-272 |
0.71 |
CC(C)C[C@H](NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(O)=O
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| MolPort-009-758-553 |
0.71 |
Cl.CC[C@@H](C)[C@H](NC(=O)C1CCN(CC1)C(=O)[C@@H](N)CC1=CC=CC=C1)C(O)=O
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| MolPort-009-758-615 |
0.71 |
Cl.CC(C)[C@H](N)C(=O)NC[C@H]1CC[C@@H](CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
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|
| MolPort-027-814-633 |
0.71 |
CN(CC(=O)N1C[C@H]([C@@H](C1)C1=CC=C(F)C=C1)C(O)=O)C1CCCC1
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|
| MolPort-042-632-969 |
0.71 |
CN(C)C(=O)CN1CC[C@@H](NC(=O)CCC2=CC=C(C)C=C2)[C@H](O)C1
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|
| MolPort-000-784-046 |
0.71 |
[Cl-].CC[C@@H](C)[C@H](NC(=O)C1CCN(CC1)C(=O)[C@@H]([NH3+])CC1=CC=CC=C1)C(O)=O
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|
| MolPort-000-787-013 |
0.71 |
[Cl-].C[C@@H]([NH3+])C(=O)NC[C@H]1CC[C@@H](CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
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| MolPort-002-511-902 |
0.71 |
CC(C)(C)OC(=O)NC(CC1=CC=CC=C1)C(=O)N1CCC[C@@H]1C(O)=O
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0.71 |
Cl.CC(C)C[C@@H](NC(=O)C1CCN(CC1)C(=O)[C@@H](N)CC1=CC=CC=C1)C(O)=O
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CO[C@@H]1CN[C@H](C1)C(=O)N1CCCN(CCCC2=CC=CC=C2)CC1
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|
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Cl.CCC(C)[C@H](N)C(=O)NC[C@H]1CC[C@@H](CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
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0.71 |
CC(C)[C@H](NC(=O)[C@@H](NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](C)NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(C)C)C(=O)NCC(N)=O
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[Cl-].CC(C)C[C@@H](NC(=O)C1CCN(CC1)C(=O)[C@@H]([NH3+])CC1=CC=CC=C1)C(O)=O
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0.71 |
C[C@H](N(C)C)C(=O)NC(CC1=CC=CC=C1)C(=O)N1CCN(C)CC1
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Cl.CC(C)[C@@H](N)C(=O)NC[C@H]1CC[C@@H](CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
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CCC(CC(=O)N1CCCC1C(=O)NC1CC1)C1=CC=CC=C1
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0.71 |
CN(CC(O)=O)C1CN(C[C@H]1O)C(=O)C1CC1C1=CC=C(F)C=C1
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0.71 |
COC(=O)CC[C@@H]1NC(=O)[C@@H](CC2=CC=C(O)C=C2)NC1=O
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OC(=O)C(F)(F)F.NCCCCC1NC(=O)C(CC2=CC=CC=C2)NC(=O)C(CC(O)=O)NC(=O)CNC(=O)C(CCCN=C(N)N)NC1=O
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0.71 |
CC(C)C[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)C(C)(C)NC(=O)C(C)(C)NC(=O)[C@H](CC1=CC=C(O)C=C1)N(CC=C)CC=C)C(O)=O
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0.71 |
COC1=CC=C(C[C@@H]2NC(=O)[C@H](CC(C)C)NC(=O)CN(C[C@@H](NC(=O)[C@@H](C)NC2=O)C(C)C)C(=O)C(C)(C)OC)C=C1
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0.71 |
NCCCC[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CC(O)=O)NC(=O)CNC(=O)[C@H](CCCNC(N)=N)NC1=O
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COCC(=O)N1C[C@@H](NC(=O)[C@@H](C)NC(=O)[C@H](CC2=CC=C(OC)C=C2)NC(=O)[C@H](CC(C)C)NC(=O)C1)C(C)C
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0.71 |
COC1=CC=C(C=C1)C1(CNC(=O)[C@H]2C[C@@H](O)CN2)CCCC1
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0.71 |
CC(C)[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@H](C)NC(=O)CN(C[C@H](CC2=CC=CC=C2)NC1=O)C(=O)CCOC1=CC=CC=C1
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CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC1=O)C(=O)CC1=C(F)C=C(F)C=C1
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0.71 |
NC(=O)C[C@H](NC(=O)C1(CCN(CC1)C(=O)[C@@H]1CCCN1)C1=CC=CC=C1)C(O)=O
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0.71 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2)NC1=O)[C@@H](C)O)C(=O)CCOC1=CC=CC=C1
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0.71 |
C[C@@H]1NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CC(O)=O)NC1=O
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0.71 |
CN(C)C1(CNC(=O)[C@H]2CC[C@H](N2)C(O)=O)CC2=CC=CC=C2C1
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CCCCN1CCN(CC1=O)C(=O)[C@@H](O)CC1=CC=CC=C1
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CN(CC(O)=O)C1CN(C[C@H]1O)C(=O)CCCC1=CC=CC=C1
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CC(C)C(CO)NC(=O)C1(CC2=CC=CC=C2C1)N1CCCCC1
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CCN1C(CC2(CCN(CC2)C(=O)CCC2=CC=CC=C2)C1=O)C(=O)NCCCOC
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| MolPort-023-276-356 |
0.71 |
CSCC[C@H](N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(N)=O)C(=O)N[C@@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)NCC(O)=O
|
|
| MolPort-045-944-189 |
0.71 |
CC(C)C[C@@H]1NC(=O)[C@@H]2CCC[C@H]2NC(=O)[C@H](C)NC(=O)C2C[C@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CCC1=C(F)C=CC=C1
|
|
| MolPort-046-567-153 |
0.71 |
CC(C)C[C@H]1NC(=O)CN(C[C@H]2OCC[C@H](NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@H](C)N(C)C1=O)[C@@H]2O)C(C)=O
|
|
| MolPort-046-162-715 |
0.71 |
CCC(C)C(NC(=O)C(CCCCN)NC(=O)C(CCC(O)=O)NC(=O)C(CCCCN)NC(=O)C(CO)NC(=O)C(CCCCN)NC(=O)C(CCCNC(N)=N)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC1=CC=CC=C1)NC(=O)C(CC(O)=O)NC(=O)CNC(=O)C(CC(C)C)NC(=O)C(N)CC(C)C)C(=O)NCC(=O)NC(CCCCN)C(=O)NC(CCC(O)=O)C(=O)NC(CC1=CC=CC=C1)C(=O)NC(CCCCN)C(=O)NC(CCCNC(N)=N)C(=O)NC(C(C)CC)C(=O)NC(C(C)C)C(=O)NC(CCC(N)=O)C(=O)NC(CCCNC(N)=N)C(=O)NC(C(C)CC)C(=O)NC(CCCCN)C(=O)NC(CC(O)=O)C(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC(C)C)C(=O)NC(CCCNC(N)=N)C(=O)NC(CC(N)=O)C(=O)NC(CC(C)C)C(=O)NC(C(C)C)C(=O)N1CCCC1C(=O)NC(CCCNC(N)=N)C(=O)NC(C(C)O)C(=O)NC(CCC(O)=O)C(=O)NC(CO)C(O)=O
|
|
| MolPort-019-939-128 |
0.71 |
CSCC[C@H](N)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC(O)=O)C(=O)NCC(=O)N[C@@H](CCCCN)C(=O)N1CCC[C@H]1C(=O)N[C@H](C(C)C)C(=O)N[C@H](CC(N)=O)C(=O)N[C@H](CC(C)C)C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(O)=O)C(=O)N[C@@H]([C@H](C)O)C(=O)N[C@@H](C)C(=O)NCC(O)=O
|
|
| MolPort-029-913-369 |
0.71 |
CC(O)C(NC(=O)C1CC1)C(=O)NC1CCCC1C1=CC=C(F)C=C1
|
|
| MolPort-039-266-470 |
0.71 |
Cl.OC(=O)C1CCCN1CC(=O)NCC1(CCOCC1)C1=CC=CC=C1
|
|
| MolPort-042-607-500 |
0.71 |
CC(CN1CCOCC1)NC(=O)C(CC1=CC=CC=C1)NC(=O)C12CC3CC(CC(C3)C1)C2
|
|
| MolPort-027-928-900 |
0.71 |
CC(C)CC1=CC=C(C=C1)C(=O)CCC(=O)N1CC(O)CC1C(N)=O
|
|
| MolPort-039-307-410 |
0.71 |
Cl.OC(=O)[C@H]1CCCN1CC(=O)NCC1(CCOCC1)C1=CC=CC=C1
|
|
| MolPort-002-671-468 |
0.71 |
OC(=O)C1CCN(CC1)C(=O)C[C@@H](CNC(=O)[C@@H]1CCCN1)C1=CC=C(Cl)C=C1
|
|
| MolPort-028-959-778 |
0.71 |
CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-027-812-082 |
0.71 |
OC(=O)[C@@H]1CN(C[C@H]1C1=CC(F)=CC=C1)C(=O)CN1CCCCCC1=O
|
|
| MolPort-000-830-426 |
0.71 |
Cl.OC(=O)C1CCN(CC1)C(=O)C[C@@H](CNC(=O)[C@@H]1CCCN1)C1=CC=C(Cl)C=C1
|
|
| MolPort-007-567-219 |
0.71 |
CC(C)(C)OC(=O)N1CCCC1C(=O)NC(CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-038-386-694 |
0.71 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)C(CCCCCC(=O)C2CO2)NC(=O)[C@@H]2CCCCN2C1=O
|
|
| MCULE-4313023276 |
0.71 |
N1[C@@H](CCCNC(=N)N)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](CC2C=CC=CC=2)C(=O)N[C@@H](CCCCN)C1=O
|
|
| MCULE-2871651277 |
0.71 |
N1[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](CC2C=CC=CC=2)C(=O)N[C@@H](CCCCN)C1=O
|
|
| MCULE-2247377449 |
0.71 |
NCCCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](CC2C=CC=CC=2)C(=O)N1
|
|
| MCULE-3279813596 |
0.71 |
N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1C=CC(=CC=1)OC)C(COC)=O
|
|
| MCULE-3886688560 |
0.71 |
N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1C=CC(=CC=1)OC)C(=O)C(C)(C)OC
|
|
| MCULE-8660619919 |
0.71 |
CN1C(C(NCC2(C3=CC=C(Cl)C=C3)CCOCC2)=O)(C)CC(O)C1
|
|
| MCULE-5492872207 |
0.71 |
CN(C1[C@H](O)CN(C(C2C(C3=CC=C(F)C=C3)C2)=O)C1)CC(O)=O
|
|
| MCULE-9725313462 |
0.71 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2C=CC=CC=2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(=O)CC1C=CC(=CC=1F)F
|
|
| MCULE-6604836200 |
0.71 |
N1C[C@@H](C[C@@H]1C(=O)NCC1(CCCC1)C1C=CC(=CC=1)OC)O
|
|
| MCULE-4584975967 |
0.71 |
N1[C@H](CC2C=CC(=CC=2)O)C(=O)N[C@@H](CCC(OC)=O)C1=O
|
|
| MCULE-9804231164 |
0.71 |
C(=O)(N[C@H](C(O)=O)CC(N)=O)C1(C2=CC=CC=C2)CCN(CC1)C(=O)[C@@H]1CCCN1
|
|
| MCULE-3454158477 |
0.71 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(C(=O)CCOC2C=CC=CC=2)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-6800981349 |
0.71 |
N12CCC[C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CN(C(=O)CCOC1C=CC=CC=1)CC(=O)N[C@@H](C)C2=O)CC1C=CC=CC=1
|
|
| MCULE-5014383419 |
0.71 |
CN(C1(CC2=C(C=CC=C2)C1)CNC([C@@H]1N[C@H](C(O)=O)CC1)=O)C
|
|
| MCULE-5258590595 |
0.71 |
CN1C(=O)CCC1C(NC(CC1C=CC=CC=1)CCC(=O)O)=O
|
|
| MCULE-1248961696 |
0.71 |
OC(CCC(NC(C1NC(=O)CC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-1554625946 |
0.71 |
CCN(C(C=C)=O)CC(N1C[C@@H](C2=CC=CC=C2)[C@H](O)C1)=O
|
|
| MCULE-1000323687 |
0.71 |
OC(C1N(CC(NCC2(C3C=CC=CC=3)CCCCC2)=O)CCC1)=O
|
|
| MCULE-5493901884 |
0.71 |
Cl.OC([C@@H]1N(CC(NCC2(C3=CC=CC=C3)CCCC2)=O)CCC1)=O
|
|
| MCULE-6520003882 |
0.71 |
OC([C@@H]1N(CC(NCC2(C3=CC=CC=C3)CCCCC2)=O)CCC1)=O
|
|
| MCULE-6536637784 |
0.71 |
N1(C[C@@H](C[C@H]1C(N)=O)O)C1CCN(CC1)C(=O)CC1C=CC(=CC=1)C
|
|
| MCULE-1103224017 |
0.71 |
N1(CC)C(C(NCCCOC)=O)CC2(CCN(CC2)C(CCC2=CC=CC=C2)=O)C1=O
|
|
| MCULE-5233618712 |
0.71 |
CC(C(N1[C@@H](CO)CN2[C@@H](CCC2)C1)=O)CC1=C(Cl)C=CC=C1
|
|
| MCULE-3947083610 |
0.71 |
OC(CCC(NC([C@@H]1NC(=O)CC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-5215226682 |
0.71 |
[Cl-].C(=O)([C@H](CC1=CC=CC=C1)[NH3+])N1CCC(CC1)C(=O)N[C@@H](CCC(O)=O)C(O)=O
|
|
| MCULE-9000275372 |
0.71 |
OC(C1N(CC(NCC2(C3C=CC=CC=3)CCCC2)=O)CCC1)=O.Cl
|
|
| MCULE-1722342646 |
0.71 |
C1(CC2C(=CC=CC=2)C1)(N1CCCCC1)C(=O)NC(CO)C(C)C
|
|
| MCULE-5208691952 |
0.71 |
CN(C1[C@H](O)CN(C(CCCC2=CC=CC=C2)=O)C1)CC(O)=O
|
|
| MCULE-4736058446 |
0.71 |
OC([C@H]1N(CC(NCC2(C3C=CC=CC=3)CCCCC2)=O)CCC1)=O
|
|
| MCULE-8387449282 |
0.71 |
OC([C@@H]1N(CC(NCC2(C3C=CC=CC=3)CCCCC2)=O)CCC1)=O
|
|
| MCULE-9610816321 |
0.71 |
CN1[C@@H](C(NCC(C2=CC3C=CC=CC=3C=C2)O)=O)CCC1
|
|
| MCULE-7700530426 |
0.71 |
CC1=CC(CC(NC(C(N2CCCCC2)(C)C)=O)CO)=CC=C1
|
|
| MCULE-3602935306 |
0.71 |
CCC(C1C=CC=CC=1)CC(N(CC(N1CCC(C(=O)O)CC1)=O)C)=O
|
|
| MCULE-2467005809 |
0.71 |
C(=O)(N1CCCCC1)[C@H](CC1C=CC=CC=1)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-4003182028 |
0.71 |
N1(CCN(C(=O)C1)CCCC)C(=O)[C@@H](O)CC1C=CC=CC=1
|
|
| MCULE-1192206079 |
0.71 |
CCCC(C(O)=O)NCC(NCC1(C2=CC=CC=C2)CC1)=O
|
|
| MCULE-3595345465 |
0.71 |
N1[C@@H](CC2C=CC=CC=2)CN(CC1=O)CCCCCCO
|
|
| MCULE-2359611262 |
0.71 |
CC(C(C1C=CC=CC=1)CC(N(CC(N1CCC(C(=O)O)CC1)=O)C)=O)C
|
|
| MCULE-3402365202 |
0.71 |
CC[C@@H]([C@@H](C(=O)O)NCC(NCC1(C2C=CC=CC=2)CC1)=O)C
|
|
| MCULE-9503548187 |
0.71 |
C(CSC)[C@H](N)C(N[C@@H](C(C)C)C(N[C@H](C(NCC(N[C@@H](CCCCN)C(N1[C@@H](CCC1)C(N[C@H](C(C)C)C(N[C@H](CC(=O)N)C(N[C@H](CC(C)C)C(NCC(N[C@@H](CC(C)C)C(N[C@@H](C(N[C@H](C(N[C@@H]([C@@H](O)C)C(N[C@H](C(NCC(O)=O)=O)C)=O)=O)CC(O)=O)=O)CC1C=CC=CC=1)=O)=O)=O)=O)=O)=O)=O)=O)=O)CC(O)=O)=O)=O
|
|
| MCULE-1491471723 |
0.71 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@H]2CCO[C@@H]([C@H]2O)CN(C(C)=O)CC(=O)N[C@H](CC(C)C)C1=O
|
|
| MCULE-9533467890 |
0.71 |
N12C[C@@H](CC1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)=O)NC(CCC1=CC=CC=C1F)=O
|
|
| MCULE-6525128814 |
0.71 |
[C@H]1(CCCN1C(=O)OC(C)(C)C)C(=O)N[C@H](C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-5835379732 |
0.71 |
[C@@H]1(C(O)=O)CN(C[C@H]1C1=CC=CC(F)=C1)C(=O)CN1CCCCCC1=O
|
|
| MCULE-3533786218 |
0.71 |
C(=O)(OC(C)(C)C)N1CCCC1C(=O)NC(CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-6558829659 |
0.71 |
OC(C1=CC=CC=C1)C1N(C(CN2C(=O)CCC2)=O)CCCC1
|
|
| MCULE-5355225521 |
0.71 |
C1(=O)[C@H](CC(C)C)NC(=O)[C@@H](CC2=CC=CC=C2)NC(C(CCCCCC(=O)C2CO2)NC(=O)[C@@H]2CCCCN12)=O
|
|
| MCULE-5441049382 |
0.71 |
CN1C(C(NCCCC2=C(Cl)C=C(Cl)C=C2)=O)(C)CC(O)C1
|
|
| MCULE-8795129665 |
0.71 |
CC(NC(C(NC(C12CC3CC(CC(C3)C1)C2)=O)CC1=CC=CC=C1)=O)CN1CCOCC1
|
|
| MCULE-4323946500 |
0.71 |
OC([C@@H]1N(CC(NCC2(C3=CC=CC=C3)CCOCC2)=O)CCC1)=O.Cl
|
|
| MCULE-1649896747 |
0.71 |
OC(C1N(CC(NCC2(C3C=CC=CC=3)CCOCC2)=O)CCC1)=O.Cl
|
|
| MCULE-1494062995 |
0.71 |
CC(CC1=CC=C(C(CCC(N2C(C(N)=O)CC(O)C2)=O)=O)C=C1)C
|
|
| MCULE-2056339078 |
0.71 |
CC(C(C(NC1C(C2=CC=C(F)C=C2)CCC1)=O)NC(C1CC1)=O)O
|
|
| MCULE-7525377927 |
0.71 |
CN(C(CCC(NCCNC(=O)C)=O)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-7237464360 |
0.71 |
CC(C1(C(=O)O)CN(C(CN(C(=O)C)CCC2C=CC=CC=2)=O)CC1)C
|
|
| MCULE-2252755240 |
0.71 |
N1(C[C@H]2CCCN2C(=O)[C@@H]1C)C(=O)[C@H](N)CC1C=CC(=CC=1)O
|
|
| MCULE-8104657088 |
0.71 |
N1(CCC(CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O)C([C@H](C)N)=O
|
|
| MCULE-8603520719 |
0.71 |
CC(CCC(NCC(NCC(C(=O)O)CC1C=CC2C=CC=CC=2C=1)=O)=O)C
|
|
| MCULE-7983625331 |
0.71 |
CC1N(C(CN(C(=O)C)CCC2C=CC=CC=2)=O)CCC1C(=O)O
|
|
| MCULE-8684593013 |
0.71 |
CC(NCCNC(CCC(NC(C(=O)O)CC1C=CC=CC=1)=O)=O)=O
|
|
| MCULE-3692041708 |
0.71 |
O[C@@H]1C[C@](C2=CC=CC=C2)(C(NCCN2C[C@H](O)CC2)=O)C1
|
|
| MCULE-2953260090 |
0.71 |
CC(C[C@@H](C(=O)O)NC(CNC(CCC1C=CC=CC=1C)=O)=O)C
|
|
| MCULE-1321726011 |
0.71 |
N[C@H]1[C@H](C2C=CC=CC=2)CN(C([C@H]2NC(=O)CC2)=O)C1
|
|
| MCULE-1277664871 |
0.71 |
CC1=CC(CC(C2CC2)NC(C2N(C(C3CC3)=O)CCC2)=O)=CC=C1
|
|
| MCULE-9909303481 |
0.71 |
CC1=CC([C@H]2[C@H](C(N[C@]3(C(N)=O)C[C@H](O)C3)=O)C2)=CC=C1
|
|
| MCULE-7652359658 |
0.71 |
CC(C(=O)O)N(C(C1C(C2C=CC=C3C=2C=CC=C3)C1)=O)CCNC(=O)C
|
|
| MCULE-2372554167 |
0.71 |
CC(CCC(NCC(NCC(C(=O)O)CC1C=CC=C2C=1C=CC=C2)=O)=O)C
|
|
| MCULE-9105135030 |
0.71 |
N[C@H]1[C@H](C2C=CC=CC=2)CN(C([C@@H]2NC(=O)CC2)=O)C1
|
|
| MCULE-3754827203 |
0.71 |
CC1=C(C2CN(C(C3N(C(C4CC4)=O)CCC3)=O)CC2)C=CC=C1
|
|
| MCULE-5940943120 |
0.71 |
N1(CCC(CC1)C(=O)N[C@@H](CC1C=CC=CC=1)C(O)=O)C(CN)=O
|
|
| MCULE-2316803772 |
0.71 |
[Cl-].N([C@@H](C(C)C)C(O)=O)C(=O)C1CCN(CC1)C(=O)[C@H](CC1C=CC=CC=1)[NH3+]
|
|
| MCULE-5499901826 |
0.71 |
CC(C[C@@H](C(=O)O)NC(CNC(CC1C=CC(CC(C)C)=CC=1)=O)=O)C
|
|
| MCULE-7989852236 |
0.71 |
C(=O)([C@H](C(C)C)N)N1CCC(CC1)C(=O)N[C@@H](CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-8553367968 |
0.71 |
OC1CN([C@@H]2[C@H](NC(CCC3=CC=C(F)C=C3)=O)CCC2)CC1
|
|
| MCULE-6747361224 |
0.71 |
C(N)(=O)[C@H](CC(C)C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)[C@H](CC1=CC=C(O)C=C1)N
|
|
| MCULE-5193864865 |
0.71 |
CC(NCCNC(CCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)=O)=O
|
|
| MCULE-2425419247 |
0.71 |
CC(CCC(NCC(NCC(C(=O)O)CC1C=CC=C(C)C=1)=O)=O)C
|
|
| MCULE-2194045927 |
0.71 |
N1(CC[C@]([C@H](N(C)C)C1)(O)C1C=CC=CC=1)C(C1CCC1)=O
|
|
| MCULE-5778094133 |
0.71 |
N1(CCC2=CC=C(C=C2)C)C(=O)CCC1(C)C(NCCCOC)=O
|
|
| MCULE-9590432597 |
0.71 |
N1(C[C@H](CC2=CC=CC=C2)NC(=O)C1)C(=O)C(C)(C)CC
|
|
| MCULE-4362836128 |
0.71 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@H](CC1C=CC=CC=1)C2=O)C(=O)N(C)C1CCOCC1
|
|
| MCULE-9644059663 |
0.71 |
N1CC(=O)N[C@@H](CC2=CC=CC=C2)C1=O
|
|
| MCULE-9766621129 |
0.71 |
N12CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@H](C(C)C)C2=O)C(=O)NC1CCOCC1
|
|
| MCULE-2729727331 |
0.71 |
C1(CC2C=CC=CC=2)C(=O)NCC(=O)N1
|
|
| MCULE-3546967116 |
0.71 |
C(N[C@@H]([C@H](O)C)C(N[C@@H](CC1C=CC(O)=CC=1)C(N[C@@H]([C@H](O)C)C(N[C@@H](CC1C=CC(O)=CC=1)C(N[C@@H](CCC(O)=O)C(N[C@@H](CCCCN)C(N[C@@H](CC(C)C)C(O)=O)=O)=O)=O)=O)=O)=O)([C@H](CCCNC(N)=N)N)=O
|
|
| MCULE-2043367436 |
0.71 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@@H](C(C)C)C2=O)C(=O)NC1CCOCC1
|
|
| MCULE-1479461832 |
0.71 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@H](CC1=CC=CC=C1)C2=O)C(=O)N1CCNC(=O)C1
|
|
| MCULE-5537344726 |
0.71 |
CC(N1[C@@H](C(NCCC2=C3C(NC=C3)=CC=C2)=O)C[C@@H](O)C1)=O
|
|
| MCULE-5626953842 |
0.71 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@H](CC1C=CC=CC=1)C2=O)C(=O)N1C[C@@H](C)NC(=O)C1
|
|
| MCULE-4202198482 |
0.71 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2C=CC=CC=2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(C1=CC=CC=C1)=O
|
|
| MCULE-6662775025 |
0.71 |
N1(C[C@@H](C[C@H]1C(NCCOC)=O)O)C1CCN(CC1)C(=O)CC1=CC=CC(C)=C1
|
|
| MCULE-5193756643 |
0.71 |
N1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C(C)C)NC(CN(C(C2=CC=CC=C2)=O)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-3445148541 |
0.71 |
N1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C(C)C)NC(CN(C(CSC)=O)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-4757486626 |
0.71 |
CNC(C1(N(C(CCC2=C(C)C=CC=C2)=O)CCC1)COC)=O
|
|
| MCULE-5057686058 |
0.71 |
CN(C(C1(CC1)CC1C=CC=CC=1)=O)CC(N1CC(C(=O)O)CCC1)=O
|
|
| MCULE-6232761642 |
0.71 |
CCC1C=CC(C(CC(N(CC(N2CC(C(=O)O)CCC2)=O)C)=O)C)=CC=1
|
|
| MCULE-3357451375 |
0.71 |
N1(CC2(CCOCC2)N(C(=O)C1)CC)C(CCC1=CC=CC=C1)=O
|
|
| MCULE-4817228937 |
0.71 |
N1(CC(O)CN(CCC2C=CC=CC=2)C(=O)C1)C(CCCC1C=CC=CC=1)=O
|
|
| MCULE-5701478715 |
0.71 |
CC(CC1C=CC(CCC(N(CC(N2CC(C(=O)O)CCC2)=O)C)=O)=CC=1)C
|
|
| MCULE-3580063318 |
0.71 |
C(=O)([C@@H]1C[C@H](CN1)O)N1CCC(CC1)CC1C=CC(=CC=1)F
|
|
| MCULE-7641504414 |
0.71 |
CCCC(C(NC(C(OC)=O)CC1C=CC=CC=1)=O)(N)C
|
|
| MCULE-9843971659 |
0.71 |
N1C2(CCCC2)C(=O)N[C@H](CC2C=CC(=CC=2)O)C1=O
|
|
| MCULE-7674067018 |
0.71 |
CC(C1C=CC(C(CC(N(CC(N2CC(C(=O)O)CCC2)=O)C)=O)C)=CC=1)C
|
|
| MCULE-6168744213 |
0.71 |
CC1CN(C(CNC(CCC2C=CC(C)=CC=2)=O)=O)CC(C(=O)O)C1
|
|
| MCULE-7043549857 |
0.71 |
[C@@H](NC(=O)[C@H](CC(C)C)N)(C(OC)=O)CC1C=CC=CC=1
|
|
| MCULE-3699706048 |
0.71 |
CCC(C1C=CC(C)=CC=1)CC(N(CC(N1CC(C(=O)O)CCC1)=O)C)=O
|
|
| MCULE-9791129620 |
0.71 |
CC1C=CC(CCC(NCC(N2C[C@@H](C(=O)O)CCC2)=O)=O)=CC=1
|
|
| MCULE-7918917946 |
0.71 |
CCC1=CC=C(CCC(N(CC(N2CC(C(O)=O)CCC2)=O)C)=O)C=C1
|
|
| MCULE-3975592618 |
0.71 |
CC1C=CC(CCC(NCC(NC2(C(=O)O)CCCCC2)=O)=O)=CC=1
|
|
| MCULE-8970494563 |
0.71 |
C(=O)(C(N)CC(C)C)NC(CC1=CC=CC=C1)C(OC)=O
|
|
| MCULE-7761082629 |
0.71 |
CC1=CC=C(CCC(NCC(NC2(C(O)=O)CCCCCC2)=O)=O)C=C1
|
|
| MCULE-1398862316 |
0.71 |
CC(C1C=CC(CCC(N(CC(N2CC(C(=O)O)CCC2)=O)C)=O)=CC=1)C
|
|
| MCULE-7274480316 |
0.71 |
CC(N1[C@H](C(NCC(C2=CC=C(O)C=C2)O)=O)CCC1)=O
|
|
| MCULE-1850580604 |
0.71 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(=O)C(C1C=CC=CC=1)C1C=CC=CC=1)C
|
|
| MCULE-8552449023 |
0.71 |
CN1C(C(N2CCC(C(C3=CC=CC=C3)=O)CC2)=O)(C)CC(O)C1
|
|
| MCULE-6063011810 |
0.71 |
CC1C=CC(CCC(NCC(N2CC(C(=O)O)(C)CCC2)=O)=O)=CC=1
|
|
| MCULE-7245947592 |
0.71 |
CC(C(N(CC(N1CC(C(O)=O)CCC1)=O)C)=O)CC1=CC=C(C)C=C1
|
|
| MCULE-2191958529 |
0.71 |
CN(C(CCC1C=CC(C(C)(C)C)=CC=1)=O)CC(N1CC(C(=O)O)CCC1)=O
|
|
| MCULE-4480512856 |
0.71 |
CC1C=CC(CCC(NCC(N2CC(C(=O)O)CCC2)=O)=O)=CC=1
|
|
| MCULE-5289061157 |
0.71 |
CC(C(C(N(CC(N1CC(C(=O)O)CCC1)=O)C)=O)CC1C=CC=CC=1)C
|
|
| MCULE-1972716002 |
0.71 |
CC(NCC(N1C(C(C2=CC=CC=C2)O)CCC1)=O)=O
|
|
| MCULE-2500851564 |
0.71 |
CN(C(CCC1C=CC(C)=CC=1)=O)CC(N1CC(C(=O)O)CCC1)=O
|
|
| MCULE-4456145144 |
0.71 |
[C@@H](O)(C)[C@H](C(N[C@@H](CCCCN)C(N[C@H](C(N[C@H](CC(=O)N)C(N[C@@H](CC(=O)N)C(N[C@@H](CC(C)C)C(N[C@@H](CC(C)C)C(NCC(N[C@@H](CCCNC(N)=N)C(N[C@@H](C(N[C@@H](CCC(O)=O)C(N[C@@H](CC(C)C)C(N[C@@H](CO)C(NCC(O)=O)=O)=O)=O)=O)CC1C=CC=CC=1)=O)=O)=O)=O)=O)=O)=O)CC(O)=O)=O)=O)N
|
|
| MCULE-5024300052 |
0.71 |
CCC1(C(NC2C(C3C=CC=CC=3)C2)=O)NCCC1
|
|
| MCULE-6333512300 |
0.71 |
NC(C(NC(CCC1CNCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-5723469068 |
0.71 |
CC1=CC=C(CCC(NCC(NC(C(C)(C)C)C(O)=O)=O)=O)C=C1
|
|
| MCULE-5844830948 |
0.71 |
CC([C@H](C(=O)O)NC(CNC(CCC1C=CC(C)=CC=1)=O)=O)C
|
|
| MCULE-4865963588 |
0.71 |
O[C@H]1[C@@H]([C@H](C[C@@](C(=O)N[C@H](C(N)=O)CC2C=CC(=CC=2)O)(C1)O)NC(=O)CC1(CCCC1)CC(O)=O)O
|
|
| MCULE-6260195004 |
0.71 |
C1(=O)[C@H](CC(C)C)NC(COC2C=CC(=CC=2)C[C@@H](NC(=O)CN1CCOC)C(=O)N1CCC(CC1)OC)=O
|
|
| MCULE-2127400461 |
0.71 |
C1(=O)[C@H](CC(C)C)NC(COC2C=CC(=CC=2)C[C@H](NC(=O)CN1CCOC)C(=O)N1CCC(CC1)OC)=O
|
|
| MCULE-6050635686 |
0.71 |
CC(C(C(=O)O)NC(CNC(CCC1C=CC(C)=CC=1)=O)=O)C
|
|
| MCULE-7396904872 |
0.71 |
CCC(C(=O)O)(NC(CNC(CCC1C=CC(C)=CC=1)=O)=O)C
|
|
| MCULE-1682312926 |
0.71 |
CCC(C(=O)O)NC(CNC(CCC1C=CC(C)=CC=1)=O)=O
|
|
| MCULE-3251672616 |
0.71 |
CC([C@@H](C(NCC(N1C(C)CC(C2C=CC=CC=2)C1)=O)=O)N)C
|
|
| MCULE-8232198087 |
0.71 |
CC1N(CC(NCC(=O)O)=O)CC(C2C=CC=CC=2)C1
|
|
| MCULE-5796176952 |
0.71 |
CC([C@@H](C(=O)O)NC(CNC(CCC1C=CC(C)=CC=1)=O)=O)C
|
|
| MCULE-8355808788 |
0.71 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(=O)CCOC1C=CC=CC=1)C
|
|
| MCULE-4125070578 |
0.71 |
CC1C=CC(CN2C(=O)CCC2C(NC(C(=O)O)CC2C=CC=CC=2)=O)=CC=1
|
|
| MCULE-6306238587 |
0.71 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)C1CC1)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-4152684025 |
0.71 |
C1(C)(C)C(C1(C)C)C(=O)N1CCNC(=O)[C@H](CC2=CC=CC=C2)NC([C@@H]2C[C@@H](O)CN2C(=O)[C@@H](CC2C3C=CC=CC=3NC=2)NC(=O)C1)=O
|
|
| MCULE-1459291869 |
0.71 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)CN(C)C1CCCC1)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-3319287766 |
0.71 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(CCC1C=C(C)C=C(C)C=1)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-2600925439 |
0.71 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(CC1=CC=CC=N1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-8114991827 |
0.71 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(=O)CC1C3=CC=CC=C3NC=1)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-1639012906 |
0.71 |
CC(C1=C2C(C=CC=C2)=CC=C1)NC([C@@H]1N(C(C)=O)C[C@H](O)C1)=O
|
|
| MCULE-6526468629 |
0.71 |
N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1C=CC(=CC=1)OC)C(=O)[C@@H]1CCCN1
|
|
| MCULE-5466020322 |
0.71 |
OC(C1=CC=CC=C1)C1N(C(CNC(C2CC2)=O)=O)CCCC1
|
|
| MCULE-1263950029 |
0.71 |
N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1C=CC(=CC=1)OC)C(=O)[C@H]1CCCN1
|
|
| MCULE-9061227955 |
0.71 |
CN1C(C(NCCC2=C(F)C(F)=CC=C2)=O)(C)CC(O)C1
|
|
| MCULE-1498138477 |
0.71 |
Cl.CC1=C(CCNC(C2NCC(O)C2)=O)C=CC(F)=C1
|
|
| MCULE-4181798886 |
0.71 |
Cl.COC1=CC=C(CCNC(C2NCC(O)C2)=O)C=C1
|
|
| MCULE-7637416402 |
0.71 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(CCCN1C=NC=N1)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-8078143380 |
0.71 |
N12CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)OCC(=O)N[C@@H](CCC1=CC=CC=C1)C2=O)C(=O)N1CCC(CC1)OC
|
|
| MCULE-3869203855 |
0.71 |
CC(C1C=CC(CCNC(CN2C(C(=O)O)CCC2)=O)=CC=1)(C)C
|
|
| MCULE-2226419616 |
0.71 |
COC(CCC(N(C(C(=O)O)CC1C=CC=CC=1)C)=O)C
|
|
| MCULE-4703115179 |
0.71 |
O=C(C12CC3CC(C1)CC(C3)C2)NC(C(N1CCNCC1)=O)CC1C=CC=CC=1
|
|
| MCULE-7862159494 |
0.71 |
COCCN(C(C(CC1C=CC=CC=1)N)=O)CC(N(C)C)=O
|
|
| MCULE-4303804052 |
0.71 |
N1(CC(O)CN(CCC2=CC=CC=C2)C(=O)C1)C(CCC(C)C)=O
|
|
| MCULE-2693132048 |
0.71 |
N1[C@@H](C(C)C)C(=O)N(C)CC(=O)N[C@@H](CC2=CC=CC=C2)C(NCCCN(C(CCC(C)(C)C)=O)[C@H](C)C1=O)=O
|
|
| MCULE-2501938184 |
0.71 |
COC(CCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)C
|
|
| MCULE-4786193919 |
0.71 |
OC(CCCNC(C1N(C(CC2C=CC=CC=2)=O)CCC1)=O)=O
|
|
| MCULE-8000995370 |
0.71 |
CC(CC(C(N1C[C@@H](C2C=CC=CC=2)[C@H](N)C1)=O)N1C(=O)CCCC1)C
|
|
| MCULE-3048219783 |
0.71 |
OC[C@@H]1[C@H](C2=CC=CC=C2)CCN(C(CN2C(=O)CCC2)=O)C1
|
|
| MCULE-3989048025 |
0.71 |
CC(C(NCC(C1=CC=C(C(C)(C)C)C=C1)O)=O)NC(C1CCC1)=O
|
|
| MCULE-4234031625 |
0.71 |
N1[C@@H](C(C)C)C(=O)N(C)CC(=O)N[C@@H](CC2C=CC=CC=2)C(NCCCN(C(CCC(C)C)=O)[C@H](C)C1=O)=O
|
|
| MCULE-7662525546 |
0.71 |
CC(N(CC(N1CCC(C(=O)O)(O)CC1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-3742297014 |
0.71 |
N1(C[C@H](CC2=CC=CC=C2)NC(=O)C1)C(CCCC1=CC=C(C=C1)C(C)C)=O
|
|
| MCULE-3384639525 |
0.71 |
CC(C1C=CC(CCNC(CN2[C@@H](C(=O)O)CCC2)=O)=CC=1)(C)C
|
|
| MCULE-4128251260 |
0.71 |
COC(CCC(NC(C(=O)O)CC1C=CC=CC=1)=O)C
|
|
| MCULE-2882724934 |
0.71 |
OCC1(CC(NC(C2N(C(CC3=CC=CC=C3)=O)CCC2)=O)C1)CO
|
|
| MCULE-8602714868 |
0.71 |
CC(C1C=CC(CCNC(CN2[C@H](C(=O)O)CCC2)=O)=CC=1)(C)C
|
|
| MCULE-8974599045 |
0.71 |
COC1(CN(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)CCC1)CO
|
|
| MCULE-1985240186 |
0.71 |
C(C)(C)[C@H](NC)C(=O)N[C@H](C(=O)N(C)[C@@H]([C@H](CC)C)[C@@H](CC(N1[C@]([H])([C@H](OC)[C@@H](C)C(=O)N[C@H](C(=O)O)CC2=CC=CC=C2)CCC1)=O)OC)C(C)C
|
|
| MCULE-1240907336 |
0.71 |
C(C)(C)[C@H](N(C)C)C(N[C@H](C(N([C@@H]([C@@H](C)CC)[C@@H](CC(=O)N1[C@]([H])([C@H](OC)[C@@H](C)C(=O)N[C@H](C(O)=O)CC2C=CC=CC=2)CCC1)OC)C)=O)C(C)C)=O
|
|
| MCULE-8027566765 |
0.71 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(NCC2=CC=CC=C2)=O)C1
|
|
| MCULE-3373586405 |
0.71 |
N12CCC[C@@H]1C(=O)NCCOC1C=CC(C[C@@H](C(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C2=O)NC(=O)[C@H]2CCC(=O)N2)=CC=1
|
|
| MCULE-8577984744 |
0.71 |
O(C)[C@H]([C@@H](C(N[C@H](C(=O)O)CC1=CC=CC=C1)=O)C)[C@@H]1CCCN1C(C[C@H]([C@@H]([C@@H](C)CC)N(C)C([C@H](C(C)C)NC([C@H](C(C)C)NC)=O)=O)OC)=O
|
|
| MCULE-7321993031 |
0.71 |
N12CCC[C@@H]1C(=O)NCCOC1C=CC(C[C@@H](C(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C2=O)NC(=O)[C@@H]2CCC(=O)N2)=CC=1
|
|
| MCULE-3160913017 |
0.71 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)OCC(=O)N[C@H](CC1C=CC=CC=1)C2=O)C(O)=O
|
|
| MCULE-3121557413 |
0.71 |
N(C)(C)[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H]([C@@H](C)CC)[C@H](OC)CC(=O)N1CCC[C@H]1[C@H](OC)[C@H](C(=O)N[C@H](C(O)=O)CC1=CC=CC=C1)C
|
|
| MCULE-5985396619 |
0.71 |
COC1=CC=C(CCNC(C2NCC(O)C2)=O)C=C1
|
|
| MCULE-6914612284 |
0.71 |
C(C)(C)[C@H](NC)C(N[C@H](C(N([C@@H]([C@@H](C)CC)[C@H](OC)CC(N1[C@]([H])([C@H](OC)[C@@H](C)C(=O)N[C@H](C(O)=O)CC2C=CC=CC=2)CCC1)=O)C)=O)C(C)C)=O
|
|
| MCULE-6352257764 |
0.71 |
OC([C@H]1N(CC(NCCC2=CC=CC=C2)=O)CCC1)=O.Cl
|
|
| MCULE-2000362955 |
0.71 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(NCC2(C#N)CCCCC2)=O)C1
|
|
| MCULE-4092483726 |
0.71 |
OC1(C2=CC=C(F)C=C2)CN(C(CN2CC(=O)NCC2)=O)CC1
|
|
| MCULE-6196027486 |
0.71 |
C1(C2C=CC(=CC=2)OC)(CC1)C(=O)N1C[C@@H]2C[C@@H](CN2C(=O)C1)OC
|
|
| MCULE-7140041692 |
0.71 |
O=C(NC1C(=O)NCCCC1)CN1CC(C2=CC=CC=C2)CC1
|
|
| MCULE-4220601588 |
0.71 |
N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1=CC=C(C=C1)OC)C(=O)CCOC
|
|
| MCULE-5773225466 |
0.71 |
N1CCC[C@H]1C(N[C@H](C(O)(C1=CC=CC=C1)C1=CC=CC=C1)CC(C)C)=O
|
|
| MCULE-7936643163 |
0.71 |
C(O)(=O)C[C@H](NCCC(C)(C)C)C(N[C@@H](CC1=CC=CC=C1)C(OC)=O)=O
|
|
| MCULE-4805443837 |
0.71 |
CC(C(N1C(C(O)=O)CN(C)C(=O)C1)=O)CC1=CC=C(F)C=C1
|
|
| MCULE-7367186064 |
0.71 |
CC1(CN(C(C2(C3=CC=CC=C3)NCCC2)=O)CC(O)C1)C
|
|
| MCULE-2107585001 |
0.71 |
[C@H](O)(C)[C@H](C(N[C@@H](C(N[C@@H](C(N[C@@H](C(N[C@@H](C(N[C@H](C(N[C@H](C(N[C@@H](CO)C(NCC(N[C@@H](CCCNC(N)=N)C(N[C@@H]([C@@H](O)C)C(NCC(N[C@@H](CCCNC(N)=N)C(N[C@@H](CCCNC(N)=N)C(N[C@H](CC(=O)N)C(N[C@H](C(N[C@@H](C(N)=O)[C@H](C)CC)=O)C)=O)=O)=O)=O)=O)=O)=O)=O)=O)C)=O)[C@H](C)CC)=O)CC1C=CC=CC=1)=O)CC(O)=O)=O)C)=O)CC1C=CC(O)=CC=1)=O)N
|
|
| MCULE-8609894744 |
0.71 |
CCN1C(CN2C(=O)CC(C(N[C@H](C(O)=O)CC3=CC=CC=C3)=O)C2)CCC1
|
|
| MCULE-8369638167 |
0.71 |
CC1=C(C2(CC2)CNC(CN2C(=O)C(O)CCCC2)=O)C=CC=C1
|
|
| MCULE-4469331685 |
0.71 |
OC(C1C(Cl)=CC=CC=1Cl)CNC(C1NCC(O)C1)=O
|
|
| MCULE-4182986718 |
0.71 |
N1(C[C@H](C[C@H]1C(=O)NC1CC1)OC1C=CC=CC=1)C(CCC1=CC=CC=C1)=O
|
|
| MCULE-8571011130 |
0.71 |
C(O)(=O)C[C@H](NCCC(C)(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)OC
|
|
| MCULE-7561685130 |
0.71 |
OC1CCC(NC(C(NC(C(C2=CC=CC=C2)C2=CC=CC=C2)=O)CC2=CC=CC=C2)=O)CC1
|
|
| MCULE-1336321583 |
0.71 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)NCCN(C(=O)CCN2C[C@@H](C)O[C@@H](C)C2)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-5041740296 |
0.71 |
CC(C[C@H](C(=O)O)NC(C(C(C)C)NC(CC1C=CC=CC=1)=O)=O)C
|
|
| MCULE-4607060630 |
0.71 |
COC1=CC=C(C(CNC(C2(N(C)CC(O)C2)C)=O)O)C=C1
|
|
| MCULE-3555486133 |
0.71 |
CN1CCN(C(C(NC(C2CCCC2)=O)CC2=CC=CC=C2)=O)CC1
|
|
| MCULE-2299403622 |
0.71 |
CC(C(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)=O)OCC1CC1
|
|
| MCULE-5409459464 |
0.71 |
CC1=C(CCNC(C2NCC(O)C2)=O)C=CC(F)=C1
|
|
| MCULE-7128184982 |
0.71 |
OCCC1NCCN(C(C2(C3=CC=CC=C3)NCCC2)=O)C1
|
|
| MCULE-4259041213 |
0.71 |
CC(C(N(CC(=O)O)CCC1C=CC=CC=1)=O)NC(C1CCCC1)=O
|
|
| MCULE-1733130910 |
0.71 |
COCC(N1[C@H](C(N[C@@H](C(=O)N)CC2C=CC=CC=2)=O)C[C@H](OCC2C=CC(F)=CC=2)CC1)=O
|
|
| MCULE-4787573934 |
0.71 |
C(NCCC1(CCCC1)O)(=O)[C@H](CC1C=CC=CC=1)N(C)C
|
|
| MCULE-5773053585 |
0.71 |
OC(C(CC1C=CC=CC=1)CNC(CNC(CC1C=CC=CC=1)=O)=O)=O
|
|
| MCULE-2980086320 |
0.71 |
N1(CCNC(C(O)=O)C1)C(=O)CC(C)(C)C1=CC=CC=C1
|
|
| MCULE-6988636399 |
0.71 |
COCCNC(CNC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O)=O
|
|
| MCULE-3380698957 |
0.71 |
COC([C@H]1[C@H](C2=CC=C(O)C=C2)CN(C(C2N(C)CCC2)=O)C1)=O
|
|
| MCULE-3264667711 |
0.71 |
COCC1(NCCC1)CNC(CCC1C=CC=CC=1)=O
|
|
| MCULE-2774233527 |
0.71 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(=O)C1=CC=CC3C1=CC=CN=3)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-8857953612 |
0.71 |
C1(=O)[C@H](CC(C)C)NC(COC2=CC=C(C=C2)C[C@@H](NC(=O)CN1CCOC)C(=O)N1CCC(CC1)CO)=O
|
|
| MCULE-9687214446 |
0.71 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C([C@@H](C)N)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-8529449322 |
0.71 |
C(C1C=CC(O)=CC=1)[C@@H](N)C(NCC(NCC(N[C@H](C(N[C@@H](CC(C)C)C(N[C@H](CCCNC(N)=N)C(N[C@@H](CCCNC(N)=N)C(N[C@H](C(N[C@H](CCCNC(N)=N)C(N1[C@@H](CCC1)C(N[C@@H](CCCCN)C(N[C@@H](CC(C)C)C(N[C@H](CCCCN)C(O)=O)=O)=O)=O)=O)=O)[C@H](C)CC)=O)=O)=O)=O)CC1C=CC=CC=1)=O)=O)=O
|
|
| MCULE-1938294041 |
0.71 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)CNC(C)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-6589990938 |
0.71 |
C1(=O)[C@H](CC(C)C)NC(COC2=CC=C(C=C2)C[C@H](NC(=O)CN1CCOC)C(=O)N1CCC(CC1)CO)=O
|
|
| MCULE-6687638301 |
0.71 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C([C@H](C)N)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-2191456836 |
0.71 |
OC1C(CNC(C2N(C(CC3=CC=CC=C3)=O)CCC2)=O)CCCC1
|
|
| MCULE-8218582541 |
0.71 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)C1=CC(F)=CC(Cl)=C1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-7317719556 |
0.71 |
C(O)(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(O)=O)NC(=O)CCCCC1=CC=C(C(N)=N)C=C1
|
|
| MCULE-4114180362 |
0.71 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(C(CC)CC)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-9266263109 |
0.71 |
C(C[C@H]1NC(=O)CNC(=O)[C@@H](CCCN(=C)(N)N)NC(=O)[C@@H](CCCCN)NC(=O)[C@H](CC2C=CC=CC=2)NC1=O)(=O)O
|
|
| MCULE-2923542839 |
0.71 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)C(C)(C)C)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-7082742996 |
0.71 |
CC(C1=CC=CC=C1)CNC(C(N1CCC2(C(=O)NCC(O)C2)CC1)C)=O
|
|
| MCULE-2861362262 |
0.71 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(CN)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-7494405323 |
0.71 |
CC(NC1(C(N2C[C@@H](O)CC2)=O)CCC(C2=CC=CC=C2)CC1)=O
|
|
| MCULE-3577400146 |
0.71 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(C)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-1015905102 |
0.71 |
OC(C1N(CC(NCC2(C3C=CC=CC=3)CC2)=O)CCCC1)=O
|
|
| MCULE-3304659183 |
0.71 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(=O)C1C=CNC=1)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-3419069564 |
0.71 |
C(N1CCC[C@H]1C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)O)CCCCN)(=O)[C@H](CCCNC(N)=N)NC(=O)[C@]([H])([C@@H](C)CC)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CC(C)C)NC(=O)[C@@H](NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC1C=CC(O)=CC=1)CC1C=CC=CC=1
|
|
| MCULE-8402326797 |
0.71 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)CN1C=CN=C1C)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-9677408909 |
0.71 |
CC(C[C@@H](C(=O)O)NC(CNC(CCC1C=CC(Br)=CC=1)=O)=O)C
|
|
| MCULE-7692989947 |
0.71 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCNCC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-6988728044 |
0.71 |
C1(=O)[C@H](CC(C)C)NC(COC2C=CC(=CC=2)C[C@H](NC(=O)CN1CCOC)C(=O)N1CCC(CC1)C(C)(C)O)=O
|
|
| MCULE-6738542882 |
0.71 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)C1C=NNC=1)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
|
|
| MCULE-6033314198 |
0.71 |
C1(=O)[C@H](CC(C)C)NC(COC2C=CC(=CC=2)C[C@@H](NC(=O)CN1CCOC)C(=O)N1CCC(CC1)C(C)(C)O)=O
|
|
| MCULE-5131656579 |
0.71 |
N12CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)OCC(=O)N[C@@H](CCC1=CC=CC=C1)C2=O)C(=O)N1CCC(CC1)O
|
|
| MCULE-3182404104 |
0.71 |
NC(C(NC(CC1(C(=O)O)CCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-8361410531 |
0.71 |
CC(C(C(NC(C(=O)O)CC1C=CC(O)=CC=1)=O)NC(C(NC(C(NC(C(CCC/N=C(\N)/N)N)=O)CCCCN)=O)CC(=O)O)=O)C
|
|
| MCULE-2854062415 |
0.71 |
C(=O)(CN(C)C1CCCC1)N[C@@H](CC1=CC=C(C=C1)O)C(O)=O
|
|
| MCULE-4685221862 |
0.71 |
N12CCC[C@@H]1C(=O)NCCOC1C=CC(C[C@@H](C(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C2=O)NC(C2CCOCC2)=O)=CC=1
|
|
| MCULE-8705934779 |
0.71 |
O=C([C@H](N)CC1C=CC=CC=1)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC1C=CC(O)=CC=1)CCC(=O)O)CCC(=O)O)[C@H](CC)C)CCC(=O)O)CCC(=O)O)CC1C=CC=CC=1)CC(=O)O)CC(=O)N)CCCNC(=N)N
|
|
| MCULE-3426596041 |
0.71 |
N1C(=O)[C@@H](C)NC(=O)[C@H](CC2=CC=C(OC[C@H](CC3C=CC=CC=3)NC(=O)[C@@H](C(C)C)NC(=O)[C@@H]1[C@@H](C)O)C=C2)NC(=O)[C@H]1CCC(=O)N1
|
|
| MCULE-7648905253 |
0.71 |
N1(CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC1C=CC(O)=CC=1)C(=O)N[C@@H](CC(C)C)C(O)=O)C(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC1C=CC=CC=1)NC(=O)[C@@H](NC(CNC(=O)[C@@H](NC(CNC(CNC(CNC(CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](N)CC1=CC=CC=C1)=O)=O)=O)=O)CC(N)=O)=O)CC(O)=O
|
|
| MCULE-2807079870 |
0.71 |
N1C(=O)[C@@H](C)NC(=O)[C@H](CC2=CC=C(OC[C@H](CC3C=CC=CC=3)NC(=O)[C@@H](C(C)C)NC(=O)[C@@H]1[C@@H](C)O)C=C2)NC(=O)[C@@H]1CCC(=O)N1
|
|
| MCULE-3875006916 |
0.71 |
N1(C(CC2=CC=CC=C2)C(=O)N2CCOCC2)C(=O)C2C(C3CC2CC3)C1=O
|
|
| MCULE-7944023029 |
0.71 |
N12CCC[C@@H]1C(=O)NCCOC1=CC=C(C[C@@H](C(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C2=O)NC(=O)C2CC2)C=C1
|
|
| MCULE-3351052393 |
0.71 |
Cl.C(=O)(N[C@H](C(O)=O)CC(N)=O)C1(C2=CC=CC=C2)CCN(CC1)C(=O)[C@@H]1CCCN1
|
|
| MCULE-6879161142 |
0.71 |
N1(CCC[C@]1([H])C(O)=O)C(=O)C([H])(CC1C=CC=CC=1)NC(=O)OC(C)(C)C
|
|
| MCULE-2809795446 |
0.71 |
C1(C2=CC=CC=C2C)(CC(=O)N2CCCC(O)C2)CC(N(CCN(C)C)C1=O)=O
|
|
| MCULE-1940543228 |
0.71 |
N1(CCCC1C(=O)NC(CC1=CC=CC=C1)C(O)=O)C(=O)COC1C=CC=CC=1
|
|
| MCULE-2187590786 |
0.71 |
CO[C@@H]1CN(C)[C@H](C(NCC2(C3=CC(Cl)=CC=C3)CC2)=O)C1
|
|
| MCULE-4556042594 |
0.71 |
N1(CCCC1C(O)=O)C(=O)C(CC1C=CC=CC=1)NC(=O)OC(C)(C)C
|
|
| MCULE-4472817886 |
0.71 |
CC(CCC(N[C@H](C(O)=O)CC1=CC=CC=C1)=O)C
|
|
| MCULE-5485421883 |
0.71 |
OCC1(CCOCC1)CNC(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O
|
|
| MCULE-7205156624 |
0.71 |
CC(CCC(NC(C(=O)O)CC1C=CC=CC=1)=O)C
|
|
| MCULE-8640608270 |
0.71 |
CCOCC1CN(C(C2C(C3=CC=CC=C3)CCCN2)=O)CC1
|
|
| MCULE-2600621922 |
0.71 |
CC(CCC(N[C@@H](C(O)=O)CC1=CC=CC=C1)=O)C
|
|
| MCULE-4574018981 |
0.71 |
C1(CC2C(=CC=CC=2)C1)(N1CCCCC1)C(=O)NCC(COC)O
|
|
| MCULE-5531066240 |
0.71 |
CCC(C(C(N(C(C(=O)O)CC1C=CC=CC=1)C)=O)C)C
|
|
| MCULE-7544717863 |
0.71 |
N1(C[C@H]([C@H](C(O)=O)C1)C1C=CC(=CC=1)F)C(=O)CN(C)C1CCCC1
|
|
| MCULE-9176739155 |
0.71 |
CCCCC(N[C@@H](C(O)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-4894512435 |
0.71 |
[C@@H](NC(=O)[C@@H](C)NC(=O)[C@@H](N)CC1C=CC(O)=CC=1)(C(=O)N[C@@H](CC(=O)O)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)NCC(=O)N)CC1C=CC=CC=1
|
|
| MCULE-7669775555 |
0.71 |
CCCCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O
|
|
| MCULE-5770176821 |
0.71 |
CO[C@H]1C[C@H](C(N2CCN(CCCC3=CC=CC=C3)CCC2)=O)NC1
|
|
| MCULE-5308885341 |
0.71 |
CCC(C(C(NC(C(=O)O)CC1C=CC=CC=1)=O)C)CC
|
|
| MCULE-3634976673 |
0.71 |
CN(C(C1C=CC(F)=CC=1)CNC(C1NCC(O)C1)=O)C
|
|
| MCULE-6347339912 |
0.71 |
CC(CCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)C
|
|
| MCULE-9418362045 |
0.71 |
CC(C(NC(C(N1CCOCC1)=O)CC1C=CC=CC=1)=O)C(=O)O
|
|
| MCULE-9813876451 |
0.71 |
CCCC(N1C(C(NCCC2=CC(C)=CC=C2)=O)CCC1)=O
|
|
| MCULE-3815880753 |
0.71 |
[Cl-].C(=O)([C@H](CC(C)C)[NH3+])N1CCC(CC1)C(=O)N[C@H](CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-5884413597 |
0.71 |
CC(C(=O)O)N(C(CCC1C=CC=C(C)C=1)=O)CCNC(=O)C
|
|
| MCULE-3095610591 |
0.71 |
CC1C=CC(CCC(NCC(N2CCC(C(=O)O)(O)CC2)=O)=O)=CC=1
|
|
| MCULE-7177811246 |
0.71 |
CCC(C(C(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)C)CC
|
|
| MCULE-6547701408 |
0.71 |
C(=O)([C@H](CC1C=CC=CC=1)[NH3+])N1CCC(CC1)C(=O)N[C@H](CC(C)C)C(O)=O.[Cl-]
|
|
| MCULE-4120788323 |
0.71 |
CCC(C(C(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)C)C
|
|
| MCULE-5932726216 |
0.71 |
C1(=CC=C(O)C=C1)C[C@H](N)C(=O)N[C@H](C(=O)O)CC(C)C
|
|
| MCULE-3590807398 |
0.71 |
CC(CCC(N(C(C(=O)O)CC1C=CC=CC=1)C)=O)C
|
|
| MCULE-2568558777 |
0.71 |
N1(CCC2C=CC=CC=2)C(=O)CCC1(C)C(NCCOC)=O
|
|
| MCULE-5456014496 |
0.71 |
CCCC(C(N(C(C(=O)O)CC1C=CC=CC=1)C)=O)C
|
|
| MCULE-3734755291 |
0.71 |
[Cl-].C(=O)([C@H]1CC[C@@H](CC1)CNC(=O)[C@@H](C(C)C)[NH3+])N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MCULE-9807705663 |
0.71 |
CC(C(=O)O)N(C(CCC1C=CC2C=CC=CC=2C=1)=O)CCNC(=O)C
|
|
| MCULE-5344395202 |
0.71 |
N([C@@H]([C@H](C)CC)C(O)=O)C(=O)C1CCN(CC1)C(=O)[C@H](CC1=CC=CC=C1)[NH3+].[Cl-]
|
|
| MCULE-2623033000 |
0.71 |
CC(C(=O)O)N(C(CCC1C=C(C)C=C(C)C=1)=O)CCNC(=O)C
|
|
| MCULE-5825929791 |
0.71 |
N1(CC(CC1=O)C1=CC=CC=C1)CC(=O)N1CCC2(CC1)CCC(N(C)C2)=O
|
|
| MCULE-5064594371 |
0.71 |
CC(CCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)(C)C
|
|
| MCULE-8576124551 |
0.71 |
CC(C[C@@H](C(=O)O)NC(CNC(CC(C1C=CC(F)=CC=1)C)=O)=O)C
|
|
| MCULE-2389267011 |
0.71 |
CC(NC(C1NCCC1)=O)CC1=CC(C)=CC(C)=C1
|
|
| MCULE-4794964450 |
0.71 |
CCCCC(C(O)=O)NC(C(C(C)C)NC(CC1=CC=CC=C1)=O)=O
|
|
| MCULE-9805050413 |
0.71 |
CCCCC(NC(C(O)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-6147921300 |
0.71 |
C(=O)(N(C)C)CN1CC[C@H]([C@H](O)C1)NC(CCC1=CC=C(C=C1)C)=O
|
|
| MCULE-6866173364 |
0.71 |
CCCCC(N(C(C(=O)O)CC1C=CC=CC=1)C)=O
|
|
| MCULE-8638090245 |
0.71 |
OC1C=CC(C[C@H](NC(=O)[C@@H](N)CC2C=CC(O)=CC=2)C(=O)O)=CC=1
|
|
| MCULE-5911812371 |
0.71 |
CCC(CC(N(C(C(=O)O)CC1C=CC=CC=1)C)=O)C
|
|
| MCULE-3497205555 |
0.71 |
[Cl-].C(=O)([C@@H]1CC[C@H](CC1)CNC(=O)[C@H](C(C)C)[NH3+])N[C@@H](CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-2615261983 |
0.71 |
CCC(CC(NC(C(=O)O)CC1C=CC=CC=1)=O)C
|
|
| MCULE-1327538602 |
0.71 |
CC(C[C@@H](C(=O)O)NC(=O)[C@H](CC1C=CC(O)=CC=1)N)C
|
|
| MCULE-8803082761 |
0.71 |
CC(NCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)=O
|
|
| MCULE-3886816226 |
0.71 |
[Cl-].C(=O)([C@H]1CC[C@@H](CC1)CNC([C@@H](C)[NH3+])=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MCULE-2075467090 |
0.71 |
C(C1C=CC=CC=1)C(NC(=O)C([H])(N)CO)([H])C(=O)N
|
|
| MCULE-7548023769 |
0.71 |
CC(C[C@@H](C(=O)O)NC(CNC(CCC1C=CC(F)=CC=1)=O)=O)C
|
|
| MCULE-5612930580 |
0.71 |
OC1(C(N2CC(CC3=CC=CC=C3)NCC2)=O)CC1
|
|
| MCULE-8318639901 |
0.71 |
C(C1C=CC(O)=CC=1)C(N)C(=O)NC(C(O)=O)CC1C=CC=CC=1
|
|
| MCULE-2524859464 |
0.71 |
CC(CC(C(NC(C(=O)O)CC1C=CC=CC=1)=O)(C)C)C
|
|
| MCULE-3566181869 |
0.71 |
[C@@H]1(C(O)=O)CN(C[C@H]1C1C=CC=CC=1)C(CNC)=O
|
|
| MCULE-1881335134 |
0.71 |
CC(CCC(NC(C(=O)O)CC1C=CC=CC=1)=O)(C)C
|
|
| MCULE-2504375403 |
0.71 |
CC(C(=O)O)N(C(CCC1C=CC=CC=1)=O)CCNC(=O)C
|
|
| MCULE-7500460021 |
0.71 |
CN(C(CCC(C)(C)C)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-8937353432 |
0.71 |
CCCN(C([C@H](CC1C=CC=CC=1)N)=O)CC(=O)O
|
|
| MCULE-9809704437 |
0.71 |
CCC(C(C(NC(C(=O)O)CC1C=CC=CC=1)=O)C)C
|
|
| MCULE-4413607538 |
0.71 |
CCC(C1=CC=CC=C1)CC(N1C(C(NC2CC2)=O)CCC1)=O
|
|
| MCULE-1774172901 |
0.71 |
CCCC(C(NC(C(=O)O)CC1C=CC=CC=1)=O)C
|
|
| MCULE-4021181518 |
0.71 |
CN(C(C)=O)CC(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-1480977592 |
0.71 |
CCC(CC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)C
|
|
| MCULE-3311286147 |
0.71 |
CC(C(C(N1CC(CC2=CC=CC=C2)NCC1)=O)(O)C)C
|
|
| MCULE-2402698967 |
0.71 |
CNCC(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-3971835014 |
0.71 |
NCC(NC(C(N1CCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-8718492415 |
0.71 |
CCCN(C(C(CC1C=CC=CC=1)N)=O)CC(=O)O
|
|
| MCULE-7129107503 |
0.71 |
C[C@@H](C(NC(C(N1CCN(C)CC1)=O)CC1=CC=CC=C1)=O)N(C)C
|
|
| MCULE-2363380013 |
0.71 |
CC(C(=O)O)N(C(CC(C1C=CC=CC=1)(C)C)=O)CCNC(=O)C
|
|
| MCULE-2832264972 |
0.71 |
CC(C1C=CC=CC=1)CC(N(C(C(=O)O)C)CCNC(=O)C)=O
|
|
| MCULE-1321789139 |
0.71 |
NCC(NCC(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)=O)=O
|
|
| MolPort-044-484-204 |
0.71 |
OC1CCN(C1)[C@H]1CCC[C@H]1NC(=O)CCC1=CC=C(F)C=C1
|
|
| MolPort-002-529-044 |
0.71 |
C[C@H](N)C(=O)N1CCC(CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-009-758-278 |
0.71 |
Cl.CC(C)[C@H](NC(=O)C1CCN(CC1)C(=O)[C@@H](N)CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-002-528-319 |
0.71 |
CC(C)[C@H](N)C(=O)N1CCC(CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-030-008-384 |
0.71 |
CC1=CC=CC(CC(NC(=O)C2CCCN2C(=O)C2CC2)C2CC2)=C1
|
|
| MolPort-046-744-396 |
0.71 |
C[C@@H]1N(C[C@H]2CCCN2C1=O)C(=O)[C@H](N)CC1=CC=C(O)C=C1
|
|
| MolPort-046-418-737 |
0.71 |
CC(C)C[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(N)=O
|
|
| MolPort-035-697-029 |
0.71 |
CN(C)[C@@H]1CN(CC[C@]1(O)C1=CC=CC=C1)C(=O)C1CCC1
|
|
| MolPort-002-527-423 |
0.71 |
NCC(=O)N1CCC(CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-007-892-327 |
0.71 |
COCCCNC(=O)C1(C)CCC(=O)N1CCC1=CC=C(C)C=C1
|
|
| MolPort-000-780-007 |
0.71 |
[Cl-].CC(C)[C@H](NC(=O)C1CCN(CC1)C(=O)[C@@H]([NH3+])CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-045-934-696 |
0.71 |
CC(C)[C@@H]1NC(=O)COC2=CC=C(C[C@H](NC(=O)[C@H](C)NC(=O)[C@H]3CCCN3C1=O)C(=O)NC1CCOCC1)C=C2
|
|
| MolPort-045-917-842 |
0.71 |
CC(C)[C@H]1NC(=O)COC2=CC=C(C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]3CCCN3C1=O)C(=O)NC1CCOCC1)C=C2
|
|
| MolPort-046-683-510 |
0.71 |
CC(C)C[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@@H](NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@@H](NC(=O)[C@@H](N)CCCNC(N)=N)[C@@H](C)O)[C@@H](C)O)C(O)=O
|
|
| MolPort-045-939-762 |
0.71 |
C[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)COC2=CC=C(C[C@H](NC1=O)C(=O)N(C)C1CCOCC1)C=C2
|
|
| MolPort-045-933-410 |
0.71 |
C[C@@H]1NC(=O)[C@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)COC2=CC=C(C[C@H](NC1=O)C(=O)N1CCNC(=O)C1)C=C2
|
|
| MolPort-002-510-974 |
0.71 |
O=C1CNC(=O)[C@H](CC2=CC=CC=C2)N1
|
|
| MolPort-021-676-068 |
0.71 |
O=C1CNC(=O)C(CC2=CC=CC=C2)N1
|
|
| MolPort-044-441-773 |
0.71 |
CC(=O)N1C[C@H](O)C[C@@H]1C(=O)NCCC1=C2C=CNC2=CC=C1
|
|
| MolPort-045-931-735 |
0.71 |
C[C@@H]1CN(CC(=O)N1)C(=O)[C@@H]1CC2=CC=C(OCC(=O)N[C@H](CC3=CC=CC=C3)C(=O)N3CCC[C@@H]3C(=O)N[C@@H](C)C(=O)N1)C=C2
|
|
| MolPort-046-744-526 |
0.71 |
CCC(C)(C)C(=O)N1C[C@H](CC2=CC=CC=C2)NC(=O)C1
|
|
| MolPort-044-352-010 |
0.71 |
COCCNC(=O)[C@@H]1C[C@@H](O)CN1C1CCN(CC1)C(=O)CC1=CC(C)=CC=C1
|
|
| MolPort-045-934-816 |
0.71 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2)NC1=O)[C@@H](C)O)C(=O)C1=CC=CC=C1
|
|
| MolPort-045-915-959 |
0.71 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC1=O)C(=O)C1=CC=CC=C1
|
|
| MolPort-044-468-842 |
0.71 |
CNC(=O)C1(COC)CCCN1C(=O)CCC1=CC=CC=C1C
|
|
| MolPort-046-594-266 |
0.71 |
OC(=O)C(F)(F)F.C[C@@H](NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(=O)NCC(=O)N(C)[C@@H](CC1=CC=CC=C1)C(=O)NCCO
|
|
| MolPort-044-679-864 |
0.71 |
OC1=CC=C(C[C@H]2NC(=O)C3(CCCC3)NC2=O)C=C1
|
|
| MolPort-001-748-423 |
0.71 |
NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@@]1(O)C[C@@H](O)[C@H](O)[C@H](C1)NC(=O)CC1(CC(O)=O)CCCC1
|
|
| MolPort-028-773-982 |
0.71 |
CC1=CC=C(CCC(=O)NCC(=O)NC(C(O)=O)C(C)(C)C)C=C1
|
|
| MolPort-028-793-030 |
0.71 |
CCC1=CC=C(CCC(=O)N(C)CC(=O)N2CCCC(C2)C(O)=O)C=C1
|
|
| MolPort-044-326-083 |
0.71 |
CCN1C(=O)CN(CC11CCOCC1)C(=O)CCC1=CC=CC=C1
|
|
| MolPort-046-043-708 |
0.71 |
OC1CN(CC(=O)N(CCC2=CC=CC=C2)C1)C(=O)CCCC1=CC=CC=C1
|
|
| MolPort-019-939-225 |
0.71 |
CC(C)C[C@H](NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](CC(N)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](N)[C@@H](C)O)C(=O)NCC(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C(=O)NCC(O)=O
|
|
| MolPort-023-271-568 |
0.71 |
O[C@H]1CN[C@@H](C1)C(=O)N1CCC(CC2=CC=C(F)C=C2)CC1
|
|
| MolPort-045-176-576 |
0.71 |
NC(=O)C(CC1=CC=CC=C1)NC(=O)CCC1CCNC1
|
|
| MolPort-046-570-602 |
0.71 |
CC(C)[C@H]1NC(=O)[C@H](CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC1=O)NC(=O)C(C1=CC=CC=C1)C1=CC=CC=C1
|
|
| MolPort-046-570-490 |
0.71 |
CC(C)[C@H]1NC(=O)[C@H](CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC1=O)NC(=O)CCOC1=CC=CC=C1
|
|
| MolPort-046-095-717 |
0.71 |
CC(NC(=O)[C@H]1C[C@@H](O)CN1C(C)=O)C1=CC=CC2=CC=CC=C12
|
|
| MolPort-039-227-920 |
0.71 |
Cl.COC1=CC=C(CCNC(=O)C2CC(O)CN2)C=C1
|
|
| MolPort-045-916-680 |
0.71 |
COC1CCN(CC1)C(=O)[C@@H]1CC2=CC=C(OCC(=O)N[C@@H](CCC3=CC=CC=C3)C(=O)N3CCC[C@H]3C(=O)N[C@@H](C)C(=O)N1)C=C2
|
|
| MolPort-046-569-693 |
0.71 |
COC1=CC=C(C[C@@H]2NC(=O)[C@H](CC(C)C)NC(=O)CN(C[C@@H](NC(=O)[C@@H](C)NC2=O)C(C)C)C(=O)[C@H]2CCCN2)C=C1
|
|
| MolPort-046-567-891 |
0.71 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CCCN1C=NC=N1
|
|
| MolPort-046-567-143 |
0.71 |
COC1=CC=C(C[C@@H]2NC(=O)[C@H](CC(C)C)NC(=O)CN(C[C@@H](NC(=O)[C@@H](C)NC2=O)C(C)C)C(=O)[C@@H]2CCCN2)C=C1
|
|
| MolPort-046-576-432 |
0.71 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC1=O)NC(=O)CC1=CNC2=CC=CC=C12
|
|
| MolPort-045-932-761 |
0.71 |
O[C@@H]1C[C@@H]2N(C1)C(=O)[C@@H](CC1=CNC3=CC=CC=C13)NC(=O)CN(CCNC(=O)[C@H](CC1=CC=CC=C1)NC2=O)C(=O)C1CC1
|
|
| MolPort-016-580-695 |
0.71 |
CC(C)[C@H](NC(=O)[C@H](CC1=CC=C(O)C=C1)NC(C)=O)C(=O)N[C@@H](C)C(=O)N[C@@H](CC(O)=O)C=O
|
|
| MolPort-045-934-324 |
0.71 |
CC1=CC(CCC(=O)N2CCNC(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](CC3=CNC4=CC=CC=C34)NC(=O)C2)=CC(C)=C1
|
|
| MolPort-045-915-429 |
0.71 |
CN(CC(=O)N1CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](CC2=CNC3=CC=CC=C23)NC(=O)C1)C1CCCC1
|
|
| MolPort-045-917-228 |
0.71 |
CC1(C)C(C(=O)N2CCNC(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@@H]3C[C@@H](O)CN3C(=O)[C@@H](CC3=CNC4=CC=CC=C34)NC(=O)C2)C1(C)C
|
|
| MolPort-039-227-966 |
0.71 |
Cl.CC1=CC(F)=CC=C1CCNC(=O)C1CC(O)CN1
|
|
| MolPort-045-933-531 |
0.71 |
CC[C@H](C)[C@@H]1NC(=O)CN(CC2=NC=CC=C2)CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O
|
|
| MolPort-044-649-386 |
0.71 |
CC[C@H](C)[C@@H]([C@@H](CC(=O)N1CCC[C@H]1[C@H](OC)[C@@H](C)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O)OC)N(C)C(=O)[C@@H](NC(=O)[C@@H](NC)C(C)C)C(C)C
|
|
| MolPort-046-742-873 |
0.71 |
CC(C)C1=CC=C(CCCC(=O)N2C[C@H](CC3=CC=CC=C3)NC(=O)C2)C=C1
|
|
| MolPort-028-274-527 |
0.71 |
CC(NC(=O)C1CCC1)C(=O)NCC(O)C1=CC=C(C=C1)C(C)(C)C
|
|
| MolPort-046-761-272 |
0.71 |
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0.71 |
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COCCC(=O)N1C[C@@H](NC(=O)[C@@H](C)NC(=O)[C@H](CC2=CC=C(OC)C=C2)NC(=O)[C@H](CC(C)C)NC(=O)C1)C(C)C
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COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(O)=O)NCCC(C)(C)C
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CCN1CCCC1CN1CC(CC1=O)C(=O)N[C@H](CC1=CC=CC=C1)C(O)=O
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CC(C)C[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](C)N(C)C1=O)C(=O)CCN1C[C@H](C)O[C@H](C)C1
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CCN1CCCC1CN1CC(CC1=O)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
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CC(OCC1CC1)C(=O)NC(CC1=CC=CC=C1)C(=O)N1CCCC1
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OC1CCCCC1CNC(=O)C1CCCN1C(=O)CC1=CC=CC=C1
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CC(=O)NC1(CCC(CC1)C1=CC=CC=C1)C(=O)N1CC[C@H](O)C1
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CN(C)CCN1C(=O)CC(CC(=O)N2CCCC(O)C2)(C1=O)C1=C(C)C=CC=C1
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CO[C@H]1C[C@H](N(C)C1)C(=O)NCC1(CC1)C1=CC=CC(Cl)=C1
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CC[C@@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](NC(=O)CNC(=O)[C@@H](CC1=CC=C(O)C=C1)NC(=O)[C@@H](NC(=O)[C@@H](CC(N)=O)NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(C)C)[C@@H](C)CC)C(C)C)C(O)=O
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| MolPort-023-276-158 |
0.70 |
CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](C)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(C)C)[C@@H](C)CC)C(C)C)C(O)=O
|
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| MolPort-023-276-157 |
0.70 |
CC[C@H](C)[C@H](NC(=O)[C@H](CCCCN)NC(=O)[C@@H](NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC1=CC=C(O)C=C1)NC(=O)[C@@H](NC(=O)[C@H](CC(N)=O)NC(=O)[C@@H](N)CC1=CC=C(O)C=C1)C(C)C)[C@@H](C)CC)C(C)C)C(O)=O
|
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0.70 |
CNC(=O)[C@H]1C[C@@H](CN1C(=O)CCC1=CC=C(OC)C=C1)OC1=CC=CC=C1
|
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CN(CC(=O)N1CCCC(C1)C(O)=O)C(=O)C1CC2=CC=CC=C12
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CNC(=O)[C@@H]1C[C@@H](CN1C(=O)CCC1=CC=C(OC)C=C1)OC1=CC=CC=C1
|
|
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0.70 |
NC(=O)NC(CC1=CC=CC=C1)C(=O)N1CCC2(CCOC2)C1
|
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| MolPort-044-538-183 |
0.70 |
CC(O)(CNC(=O)[C@H](CO)NC(=O)CC1=CC=C(F)C=C1)C1CC1
|
|
| MolPort-000-702-405 |
0.70 |
[Cl-].COC(=O)C(CC1=CC=CC=C1)NC(=O)C([NH3+])CC(C)C
|
|
| MolPort-046-569-744 |
0.70 |
CC(C)[C@H]1NC(=O)[C@H](CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC1=O)NC(=O)C1CC2=CC=CC=C2C1
|
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| MolPort-046-089-178 |
0.70 |
CC(O)C(NC(=O)C1CC1)C(=O)N1CCC(CC2=CC=C(F)C=C2)C1
|
|
| MolPort-019-821-853 |
0.70 |
OC1(CN2CCCNC(=O)C2)CCCN(CCC2=CC=CC=C2)C1=O
|
|
| MolPort-028-734-793 |
0.70 |
O=C(CN1CC(CC1=O)C1=CC=CC=C1)N1CCC(CC1)C1=CC(=CC=C1)C#N
|
|
| MolPort-045-917-213 |
0.70 |
O[C@@H]1C[C@@H]2N(C1)C(=O)[C@@H](CC1=CNC3=CC=CC=C13)NC(=O)CN(CCNC(=O)[C@H](CC1=CC=CC=C1)NC2=O)C(=O)[C@@H]1CCC(=O)N1
|
|
| MolPort-039-293-739 |
0.70 |
OC1CNC(C1)C(=O)N1CCC(CC2=CC=CC(F)=C2)CC1
|
|
| MolPort-045-932-918 |
0.70 |
O[C@@H]1C[C@@H]2N(C1)C(=O)[C@@H](CC1=CNC3=CC=CC=C13)NC(=O)CN(CCNC(=O)[C@H](CC1=CC=CC=C1)NC2=O)C(=O)CN1CCCC1=O
|
|
| MolPort-045-993-166 |
0.70 |
CC(C)CC(=O)NC(CC1=CC=CC=C1)C(=O)N1CCN(C)CC1
|
|
| MolPort-009-757-440 |
0.70 |
Cl.COC(=O)C(CC1=CC=CC=C1)NC(=O)C(N)CC(C)C
|
|
| MolPort-046-570-112 |
0.70 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC1=O)NC(=O)C1=CC(Cl)=CC(F)=C1
|
|
| MolPort-046-139-692 |
0.70 |
CCN1CCN(CC1)C(=O)C(CC1=CC=CC=C1)NC(=O)CC
|
|
| MolPort-046-036-346 |
0.70 |
CN(C1CC(C1)C1=CC=CC=C1)C(=O)[C@H]1CC[C@H](N1)C(O)=O
|
|
| MolPort-046-569-264 |
0.70 |
CC(C)C[C@@H]1NC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CCCNC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@H](C)NC1=O)NC(=O)C1=CC(=CC=C1)C1=CC(F)=CC=C1
|
|
| MolPort-045-919-239 |
0.70 |
O[C@@H]1C[C@@H]2N(C1)C(=O)[C@@H](CC1=CNC3=CC=CC=C13)NC(=O)CN(CCNC(=O)[C@H](CC1=CC=CC=C1)NC2=O)C(=O)CCC1=CC=NC=C1
|
|
| MolPort-045-933-023 |
0.70 |
CC[C@H](C)[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O)C(=O)C1=CC(OC(F)F)=CC=C1
|
|
| MolPort-044-476-330 |
0.70 |
OC1CCCCN(CC(=O)NC2CC3=CC=CC=C3C2)C1=O
|
|
| MolPort-004-999-874 |
0.70 |
OCCN1CCN(CC1)C(=O)CC1(CC(=O)N(CC2CCCCC2)C1=O)C1=CC=CC=C1
|
|
| MolPort-044-473-056 |
0.70 |
CN(C1CC2=CC=CC=C2C1)C(=O)CN1CCCCC(O)C1=O
|
|
| MolPort-046-740-150 |
0.70 |
O=C(CC(C1=CC=CC=C1)C1=CC=CC=C1)N1C[C@H](CC2=CC=CC=C2)NC(=O)C1
|
|
| MolPort-039-232-019 |
0.70 |
CC(NC(=O)CN1CCCCCCC1=O)C(O)C1=CC=C(F)C=C1
|
|
| MolPort-030-045-680 |
0.70 |
O[C@H]1CN[C@H](C1)C(=O)NCCC1=C(Cl)C=C(Cl)C=C1
|
|
| MolPort-027-858-397 |
0.70 |
OC(=O)[C@@H]1CN(CC(=O)N2CCCCC2)C[C@H]1C1=CC=C(F)C=C1
|
|
| MolPort-045-959-381 |
0.70 |
COC1=CC=C(C[C@@H]2NC(=O)[C@H](CCCN)NC2=O)C=C1
|
|
| MolPort-039-293-724 |
0.70 |
OC1CNC(C1)C(=O)NCCC1=CC=CC(Cl)=C1Cl
|
|
| MolPort-046-041-331 |
0.70 |
CCN1C(CC2(CCN(CC2)C(=O)CCC2=CC=CC=C2)C1=O)C(=O)NCCOC
|
|
| MolPort-044-533-694 |
0.70 |
CC(C)OC1=CC=C(CCNC(=O)C2(C)CC(O)CN2C)C=C1
|
|
| MolPort-027-870-707 |
0.70 |
CNC(=O)CN1C[C@H](NC(=O)C2(COC)CCC2)[C@H](C1)C1=CC=CC=C1
|
|
| MolPort-028-274-340 |
0.70 |
CC(CC(=O)N1CCCC1C(=O)N1CCOCC1)C1=CC=CC=C1C
|
|
| MolPort-039-227-922 |
0.70 |
Cl.OC1CNC(C1)C(=O)NCCC1=CC=C(Cl)C=C1Cl
|
|
| MolPort-005-944-467 |
0.70 |
O=C1N[C@@H](CC2=CC=CC=C2)CN2CCCC[C@@H]12
|
|
| MolPort-046-750-426 |
0.70 |
CN(C)[C@@H](CC1=CC=CC=C1)C(=O)N1CCC(CC1)C1(O)CC1
|
|
| MolPort-044-461-195 |
0.70 |
CN1CCN(CC1)C(=O)CN1CCC(CO)(C1)C1=CC=CC=C1
|
|
| MolPort-046-544-286 |
0.70 |
CO[C@H]1C[C@@H](N(C1)C(C)=O)C(=O)NCCC1=C(OC)C=CC2=CC=CC=C12
|
|
| MolPort-046-417-070 |
0.70 |
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|
| MolPort-045-931-753 |
0.70 |
CC(C)C[C@@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)CN1C=CN=C1
|
|
| MolPort-046-741-940 |
0.70 |
C[C@@H]1NC(=O)[C@H](CC2=CC=C(OCCNC(=O)C3(CC3)NC(=O)[C@@H](CC3=CC=CC=C3)NC1=O)C=C2)NC(=O)[C@@H]1CCC(=O)N1
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|
| MolPort-044-639-164 |
0.70 |
CO[C@H]1C[C@H]2CN([C@@H](CC3=CC=CC=C3)C(=O)N2C1)C(=O)CCN1C=CN=C1
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|
| MolPort-046-757-694 |
0.70 |
C[C@@H]1NC(=O)[C@H](CC2=CC=C(OCCNC(=O)C3(CC3)NC(=O)[C@@H](CC3=CC=CC=C3)NC1=O)C=C2)NC(=O)[C@H]1CCC(=O)N1
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| MolPort-009-758-018 |
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|
| MolPort-046-417-069 |
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| MolPort-028-904-613 |
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CNC(=O)C(CC(C)C)NC(=O)[C@H](O)C1=CC=CC=C1
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|
| MolPort-046-567-276 |
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CC(C)[C@@H]1NC(=O)[C@@H](C)N(CCCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)CN(C)C1=O)C(=O)C1CCC1
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| MolPort-005-074-846 |
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O=C(CN1CC(CC1=O)C1=CC=CC=C1)N1CCC(CC1)OCC1=CC=CC=C1
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OC(=O)[C@@H]1NC(=O)C[C@H]1C1=CC=CC=C1
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| MolPort-019-939-171 |
0.70 |
CC(C)C[C@H](NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@@H](CC1=CC=C(O)C=C1)NC(=O)CNC(=O)[C@@H](CCCNC(N)=N)NC(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CO)NC(=O)[C@@H](C)NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@H]1CCCN1C(=O)[C@H](CO)NC(=O)[C@H](CCC(N)=O)NC(=O)[C@@H](CC1=CC=CC=C1)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@@H](CCC(O)=O)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](NC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](N)CC1=CC=CC=C1)C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N1CCC[C@@H]1C(=O)N[C@H](CCCNC(N)=N)C(=O)N[C@H](CC(N)=O)C(N)=O
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| MolPort-027-819-306 |
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OC(=O)[C@@H]1CN(C[C@H]1C1=CC=C(F)C=C1)C(=O)CN1CCCCCCC1
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CC(C)C(=O)N1C[C@@H]2C[C@@H](O)CN2C2(CN(CCC3=CC=CC=C3)C2)C1
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CN1C[C@@H](C[C@H]1CO)NC(=O)CC(C)(C)C1=CC=CC=C1
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CC(N1CCC(CC2=CC=CC=C2)CC1)C(=O)N1CCC[C@H]1C(O)=O
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|
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N[C@@H](CC1=CC=CC=C1)C(=O)N1CCC(O)(C1)C(F)(F)F
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CC1=C(C=CC=C1)[C@@H]1CN(C[C@H]1C(O)=O)C(=O)CN1CCCCC1
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NC(=O)CN1C[C@H](NC(=O)CN2CCCCC2=O)[C@H](C1)C1=CC=CC=C1
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OC(=O)CN1CCCCC(N2CCC(CC2)C2=CC=CC3=CC=CC=C23)C1=O
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O=C(C[C@H]1CCOC1)N1CCCNC(=O)C1CC1=CC=CC=C1
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CC(N1CCC(CC2=CC=CC=C2)CC1)C(=O)N1CCCC1C(O)=O
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|
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N1[C@@H](C(C)C)C(=O)N(C)CC(=O)N[C@@H](CC2=CC=CC=C2)C(NCCCN(C(COC)=O)[C@H](C)C1=O)=O
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CC(C1C=CC=CC=1)CC(N1[C@H](C(=O)O)CCC1)=O
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CCCN(C(CNC(CCC1C=CC(C)=CC=1)=O)=O)CC(=O)O
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CC(C(C1C=CC=CC=1)CC(N1C(C(=O)O)CCC1)=O)C
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CN1C(=O)CN(CC(N2C(C(C3=CC=CC=C3)O)CCC2)=O)CC1
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|
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CCC1C=CC(CCC(N(C(C(=O)O)C)CCNC(=O)C)=O)=CC=1
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CO[C@@H]1CN(C(CCC2=CC(OC)=CC=C2)=O)[C@H](C(N)=O)C1
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|
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CC1([C@@H](C(N[C@@H](C(=O)O)CC2C=CC=CC=2)=O)C1)C
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|
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C(N1CCC[C@H]1C(N[C@@H](CCCCN)C(N1CCC[C@H]1C(N[C@@H](CCC(N)=O)C(N[C@@H](CCC(N)=O)C(N[C@@H](CC1=CC=CC=C1)C(O)=O)=O)=O)=O)=O)=O)([C@H](CCCNC(N)=N)N)=O
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| MCULE-9378638091 |
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CC1C(C(N[C@@H](C(O)=O)CC2=CC=CC=C2)=O)C1
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|
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COCCC(C(=O)O)NC(C(NC(C1C=CC=CC=1)=O)CC1C=CC=CC=1)=O
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|
| MCULE-9335747448 |
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CCC(C1C=CC=CC=1)CC(N1C(C(=O)O)CCC1)=O
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|
| MCULE-2860145048 |
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CCOC1=CC=C(CCC(N2[C@H](C(N)=O)C[C@H](OC)C2)=O)C=C1
|
|
| MCULE-8497863078 |
0.70 |
CC(C1C=CC=CC=1)CC(N1C(C(=O)O)(C)CCC1)=O
|
|
| MCULE-9259824796 |
0.70 |
C(=O)(C1CCC(CC1)C)NC(CC1=CC=CC=C1)C(NCCC1C=CC=CC=1)=O
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|
| MCULE-7477839849 |
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OC(C(NCC1N(CCC2=CC=CC=C2)CCC1)=O)=O
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|
| MCULE-1166309831 |
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OCC1N(C(CNC(CC2=CC=CC=C2)=O)=O)CCC1
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|
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CC1(C(C)(C)C1C(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)C
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|
| MCULE-3496905161 |
0.70 |
N1(C)[C@@H](C)C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C(=O)N[C@@H](CC2=CC=CC=C2)CN(C(C2CCCC2)=O)CC(=O)N[C@@H](CC(C)C)C1=O
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|
| MCULE-1172689973 |
0.70 |
CC(NC(C1NC(=O)CC1)=O)CC1=CC2=C(C=CC=C2)C=C1
|
|
| MCULE-8349208475 |
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O=C(C1CCNCC1)NC(C(N1CCCC1)=O)CC1C=CC=CC=1
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|
| MCULE-1033805639 |
0.70 |
CC(C1C=CC=CC=1)CC(N1C(C(=O)O)CCC1)=O
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|
| MCULE-6073711852 |
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N1(CC[C@H]([C@H](O)C1)C1=CC=C2C(C=CC=C2)=C1)C(=O)CNC(C)=O
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|
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CCC(N(C(CNC(CCC1C=CC(C)=CC=1)=O)=O)CC(=O)O)C
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|
| MCULE-8874627437 |
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C(C1CCCCC1)(=O)NC(CC1=CC=CC=C1)C(NCCC1C=CC=CC=1)=O
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|
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CC(NCC(NCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)=O)=O
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|
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CC(C1=CC=CC=C1)(CNC(C12N(C3CC3)CC(C1)C2)=O)O
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|
| MCULE-6088400915 |
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NCCCC(NC(C(N1CCCC1)=O)CC1C=CC=CC=1)=O
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|
| MCULE-8741763363 |
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O=C(NC(C(NC1CC1)=O)CC1C=CC=CC=1)CCC1CCNCC1
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|
| MCULE-2456662488 |
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N1(CCCC1C(O)=O)C(CCC1C=CC=CC=1)=O
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|
| MCULE-4625199277 |
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CCCN1C(C(N2C[C@@H](C3C=CC=CC=3)[C@H](N)C2)=O)CCC1
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|
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CC(C1C=CC=CC=1)(CC(N1[C@H](C(=O)O)CCC1)=O)C
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|
| MCULE-1829494576 |
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OCC(NC(C1CCN(C(CCC2=CC=CC=C2)=O)CC1)=O)CN1CCCCC1
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|
| MCULE-2147933115 |
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CC(C1C=CC(CCC(N(C(C(=O)O)C)CCNC(=O)C)=O)=CC=1)C
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|
| MCULE-8299297867 |
0.70 |
N[C@H]1[C@H](C2C=CC=CC=2)CN(C([C@H]2NCCC2)=O)C1
|
|
| MCULE-5708521600 |
0.70 |
CN(C(C1CCC1)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-8134756594 |
0.70 |
CN(C(C(NC(C1CCCCCC1)=O)CC1=CC=CC=C1)=O)C
|
|
| MCULE-3774447217 |
0.70 |
CN(C([C@@H]1C(C)(C)C1)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-4910925321 |
0.70 |
NC(C(NC1C(=O)NCCCC1)=O)CC1C=CC=CC=1
|
|
| MCULE-2193075932 |
0.70 |
CC(C(N(C(C(=O)O)CC1C=CC=CC=1)C)=O)C1CC1
|
|
| MCULE-6854329541 |
0.70 |
CC1(C(O)CN(C(C(C2=CC=CC=C2)N2C(=O)CCCC2)=O)C1)C
|
|
| MCULE-3151661497 |
0.70 |
CC(CC(NC(C(NCC(CC1=CC=CC=C1)O)=O)C(C)C)=O)C
|
|
| MCULE-4067347976 |
0.70 |
C1(CC2C(=CC=CC=2)C1)(N1CCCCC1)C(=O)N1CCC(COC)C1
|
|
| MCULE-7418933250 |
0.70 |
CO[C@@H]1CN(C(CC2CC(C3=CC=CC=C3)C2)=O)[C@H](C(N)=O)C1
|
|
| MCULE-9029289362 |
0.70 |
CO[C@@H]1CN(C)[C@H](C(NCC2(CC3=C(C=CC=C3)C2)C)=O)C1
|
|
| MCULE-8931193774 |
0.70 |
O=C(NC(C(NC1CC1)=O)CC1=CC=CC=C1)CCC1OCCCC1
|
|
| MCULE-7071709667 |
0.70 |
C1(O)C=CC(CC(NC(=O)C(NC(=O)C)([H])CC2C=CC=CC=2)([H])C(=O)OC)=CC=1
|
|
| MCULE-3260803976 |
0.70 |
CCC1=CC=C(CN(C([C@@H]2N(C(C)=O)C[C@H](O)C2)=O)C2CC2)C=C1
|
|
| MCULE-4792378603 |
0.70 |
CO[C@H]1C[C@H](C(NCCCC2=CC(F)=CC=C2)=O)NC1
|
|
| MCULE-7001485047 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)N[C@H](CC1C=CC(=CC=1)O)C2=O)N(C)C
|
|
| MCULE-5996059071 |
0.70 |
[O-]C(C1N(C2CC2)C(C(NC2CC3=C(C=CC=C3)C2)=O)CC1)=O.[Na+]
|
|
| MCULE-1320827028 |
0.70 |
CCC(C(N1CCOCC1)=O)NC([C@]1(C2=CC=CC=C2)C[C@H](O)C1)=O
|
|
| MCULE-8330276583 |
0.70 |
OC1C(=O)N(CC(NC2(CC2)CC2=CC=C(F)C=C2)=O)CCCC1
|
|
| MCULE-4132602203 |
0.70 |
N(C(C(C)C)C(O)=O)C(=O)C(CC1C=CC=CC=1)NC(C1=CC=CC=C1)=O
|
|
| MCULE-2710536307 |
0.70 |
N1(CC(CC1=O)C1=CC=CC=C1)CC(=O)N1CCCC2(CCOCC2)C1
|
|
| MCULE-7496054126 |
0.70 |
Cl.CO[C@H]1C[C@H](C(NCCCC2=CC(F)=CC=C2)=O)NC1
|
|
| MCULE-8331155006 |
0.70 |
CN([C@H]1[C@H](O)CCC1)CC(N1C[C@H](C2=CC=CC=C2)[C@@H](C(N)=O)C1)=O
|
|
| MCULE-4103677423 |
0.70 |
Cl.CO[C@H]1C[C@H](C(NCC2(CCCC2)CC2=CC=CC=C2)=O)NC1
|
|
| MCULE-7963988193 |
0.70 |
CC(C(C(NCC1C2=C(C=CC=C2)CC1)=O)NC(C1CCCC1)=O)O
|
|
| MCULE-5675127825 |
0.70 |
CN(C(C)=O)CC(N1C[C@@H](C2=CC=C(Cl)C=C2)[C@H](C(O)=O)C1)=O
|
|
| MCULE-5599301615 |
0.70 |
CO[C@H]1C[C@H](C(NCC2(CCCC2)CC2=CC=CC=C2)=O)NC1
|
|
| MCULE-8504911599 |
0.70 |
N1([C@@H]2CC[C@H]1C[C@@H](C1C=CC(=C(C)C=1)F)C2)C(=O)[C@@H]1C[C@H](CN1)O
|
|
| MCULE-3914794899 |
0.70 |
N1(CCC[C@H]1C(NC)=O)C(=O)[C@H]1CC2=CC=C(C=C2)OCC(N[C@@H](CC(C)C)C(=O)N(CCOC)CC(=O)N1)=O
|
|
| MCULE-4087556297 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=C(C=C1)O)C2=O)N(C)C
|
|
| MCULE-6190523170 |
0.70 |
C(O)(=O)[C@H](CCCCNC(=O)[C@H](CC1=CC=C2C(=C1)C=CC=C2)NC([C@@H]1CC[C@@H](CNC(CN2CCN(CC(O)=O)CCN(CC(O)=O)CCN(CC(O)=O)CC2)=O)CC1)=O)NC(N[C@H](C(O)=O)CCC(O)=O)=O
|
|
| MCULE-7598461635 |
0.70 |
CO[C@@H]1CN(C(CCC2=CC=C(C#N)C=C2)=O)[C@H](CN2CCCC2)C1
|
|
| MCULE-3649473979 |
0.70 |
N1(CCC[C@H]1C(NC)=O)C(=O)[C@@H]1CC2=CC=C(C=C2)OCC(N[C@@H](CC(C)C)C(=O)N(CCOC)CC(=O)N1)=O
|
|
| MCULE-1403565397 |
0.70 |
OC1C(=O)N(CC(NCC2(C3=CC(F)=CC=C3)CC2)=O)CCCC1
|
|
| MCULE-6751951540 |
0.70 |
CC(N(CC(N1CC(C(O)=O)CCC1)=O)CCC1=CC=CC=C1)=O
|
|
| MCULE-4984851917 |
0.70 |
OC([C@H]1N[C@@H](C(NCC2(C3=CC(C(F)(F)F)=CC=C3)CC2)=O)CC1)=O
|
|
| MCULE-8573331484 |
0.70 |
C(=O)(C1(C2=CC=CC=C2)CCN(CC1)C)N1CCN(C(CCO)C1)CC(C)C
|
|
| MCULE-8359882692 |
0.70 |
N1(C[C@H]([C@H](C(O)=O)C1)C1C=CC=CC=1C)C(=O)C(C)(C)NC(C)=O
|
|
| MCULE-1638330471 |
0.70 |
N1(C[C@@H]([C@H](CN(C)CCO)C1)CO)C(=O)CN1CCC(CC1)C1C=CC=CC=1
|
|
| MCULE-9469580305 |
0.70 |
C1(N(C)CCC2C=CC=CC=2)(CC2C(=CC=CC=2)C1)C(=O)N[C@@H]1CNC[C@H]1O
|
|
| MCULE-6556527158 |
0.70 |
N1(C)C(C(O)=O)C(CC1=O)C1C=CC=CC=1
|
|
| MCULE-2582137451 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)CN1CCCCCC1)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-2649843174 |
0.70 |
N1(CCC2C=CC=CC=2)C(=O)CCC1(C)C(NCCCOC(C)C)=O
|
|
| MCULE-1743657816 |
0.70 |
CCNCCNC(C(NC(C12CC3CC(C1)CC(C3)C2)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-9597246807 |
0.70 |
C(=O)([C@H](C(C)C)[NH3+])N1CCC(CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O.[Cl-]
|
|
| MCULE-2953560834 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(CCC1=CC=CN=C1)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-8052650833 |
0.70 |
CC1C=CC(CCC(NCC(NCC(C2CCCCC2)(O)C)=O)=O)=CC=1
|
|
| MCULE-2159071539 |
0.70 |
NCCNC(C(NC(C12CC3CC(CC(C3)C1)C2)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-1270753083 |
0.70 |
CC(N(CC(N1C[C@@H](C(=O)O)CCC1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-8811098715 |
0.70 |
CC(CC1=CC=CC=C1)(CNC(CNC(CC1CCCC1)=O)=O)CO
|
|
| MCULE-9013779402 |
0.70 |
CC1CN(C(CN(C(=O)C)CCC2C=CC=CC=2)=O)CC(C(=O)O)C1
|
|
| MCULE-1448261272 |
0.70 |
CCCC(C(=O)O)CNC(CN(C(=O)C)CCC1C=CC=CC=1)=O
|
|
| MCULE-4047826038 |
0.70 |
CCCC(C(=O)O)CNC(CNC(CCC1C=CC(C)=CC=1)=O)=O
|
|
| MCULE-5965216921 |
0.70 |
CCC(N1C(C(N2CC(C3=CC=C(C)C=C3)CC2)=O)CCCC1)=O
|
|
| MCULE-1577199638 |
0.70 |
N[C@H]1[C@H](C2C=CC=CC=2)CN(C(C2N(C(CC3C=CC=CC=3)=O)CCC2)=O)C1
|
|
| MCULE-6558449096 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(=O)C1=CC=C(C=C1)N1CCCC1=O)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-1639469711 |
0.70 |
CC(N(CC(N1CC(C(=O)O)(C)CCC1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-6379512140 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)NCCCC[C@H](NC(CN(C)C)=O)C(N[C@H](C)C(=O)N[C@@H](CC1C3C=CC=CC=3NC=1)C(=O)N[C@H](CC(C)C)C2=O)=O)O
|
|
| MCULE-8872888619 |
0.70 |
CC(C(=O)O)CN(C(C1N(C(CC2C=CC=CC=2)=O)CCC1)=O)C
|
|
| MCULE-7805610249 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)NCCCC[C@H](NC(CC(C)C)=O)C(N[C@H](C)C(=O)N[C@@H](CC1C3C=CC=CC=3NC=1)C(=O)N[C@H](CC(C)C)C2=O)=O)O
|
|
| MCULE-2754168774 |
0.70 |
OC([C@H]1N(CC(NCCC(C2=CC=CC=C2)C2=CC=CC=C2)=O)CCC1)=O
|
|
| MCULE-8258359247 |
0.70 |
CC(CC(C(=O)O)CNC(CN(C(=O)C)CCC1C=CC=CC=1)=O)C
|
|
| MCULE-2289849405 |
0.70 |
CC(N(CC(NC1(C(O)=O)CCCCC1)=O)CCC1=CC=CC=C1)=O
|
|
| MCULE-3451128583 |
0.70 |
OC(CN(C(CNC(CC1CCCCC1)=O)=O)CCC1=CC=CC=C1)=O
|
|
| MCULE-3129307447 |
0.70 |
NC(N1[C@H](C(N2CC(CC3=CC=CC=C3)NCC2)=O)CCC1)=O
|
|
| MCULE-2211002618 |
0.70 |
N1(C[C@@H]([C@@H](C2C=CC=CC=2)C1)N)C(=O)CN1CCCCC1=O
|
|
| MCULE-8473461602 |
0.70 |
CC(N1[C@H](C(N[C@H]2[C@H](C3=CC=C(C(F)(F)F)C=C3)C2)=O)CCC1)=O
|
|
| MCULE-7845422711 |
0.70 |
CC1=C(CCNC(CN[C@H]2[C@@H](N3CC(O)CC3)CCC2)=O)C=CC=C1
|
|
| MCULE-9167825093 |
0.70 |
O=C(N1CCCC1)CNC(C1C(C2=CC=CC=C2)CCCN1)=O
|
|
| MCULE-7214150633 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(CC1=CC=C(C)S1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-6777112155 |
0.70 |
CC(C1C=CC(C2C(C(N(C(C(=O)O)C)CCNC(=O)C)=O)C2)=CC=1)C
|
|
| MCULE-8454781973 |
0.70 |
CC(CNC(C(NC(C12CC3CC(C1)CC(C3)C2)=O)CC1C=CC=CC=1)=O)(N)C
|
|
| MCULE-2248511333 |
0.70 |
CC(N(CC(NC1(C(O)=O)CCCCCC1)=O)CCC1=CC=CC=C1)=O
|
|
| MCULE-6210239034 |
0.70 |
CC(CC1=CC=CC=C1)(CNC(CNC(CC1CCCCC1)=O)=O)CO
|
|
| MCULE-3325296303 |
0.70 |
OC(CCNC(C1N(C(CC2C=CC=CC=2)=O)CCC1)=O)=O
|
|
| MCULE-6944740322 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)CCOC)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-1032448905 |
0.70 |
CN(C(C1N(C(CC2C=CC=CC=2)=O)CCC1)=O)CCC(=O)O
|
|
| MCULE-1107785788 |
0.70 |
CNCCN(C(C(NC(C12CC3CC(C1)CC(C3)C2)=O)CC1C=CC=CC=1)=O)C
|
|
| MCULE-4513534703 |
0.70 |
NCC1(CCCCC1)CC(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-2340264062 |
0.70 |
CC(CNC1(CCN(C(CN(C(C)=O)CCC2=CC=CC=C2)=O)CC1)CO)C
|
|
| MCULE-2586491349 |
0.70 |
CN(C(CC(C1=CC=CC=C1)(O)C)=O)C1C(=O)N(C)CCCC1
|
|
| MCULE-6302086846 |
0.70 |
N1(C[C@H](CC2C=CC=CC=2)NC(=O)C1)C(CCC1=CC=C(C=C1)F)=O
|
|
| MCULE-2776937980 |
0.70 |
CC(CC(C(=O)O)CNC(CNC(CCC1C=CC(C)=CC=1)=O)=O)C
|
|
| MCULE-3775713257 |
0.70 |
C(=O)(NC1CC1)C(CC1C=CC=CC=1)NC(=O)C1CCC(CC1)C(C)C
|
|
| MCULE-1710493653 |
0.70 |
CN(C(C1C2C=CC=CC=2C1)=O)CC(N1CC(C(=O)O)CCC1)=O
|
|
| MCULE-8470959150 |
0.70 |
CN1CC(CO)N(C([C@H]2[C@H](C3=CC4=C(C=CC=C4)C=C3)C2)=O)CC1
|
|
| MCULE-4334624580 |
0.70 |
NC(NC(C(N1CC2(COCC2)CC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-9306650028 |
0.70 |
CCC(C1C=CC(C)=CC=1)CC(N(CC(N1CCC(C(=O)O)CC1)=O)C)=O
|
|
| MCULE-5817626205 |
0.70 |
C1(CC2C(=CC=CC=2)C1)(C(=O)N1CC[C@H](O)C1)N1C[C@H](C)O[C@H](C)C1
|
|
| MCULE-8138398722 |
0.70 |
NC(C(NC(CCCCC(=O)O)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-2321549036 |
0.70 |
N1(C[C@H](C[C@H]1C(=O)N1CCCC1)OC1=CC=CC=C1)C(CCC1C=CC(=CC=1)OC)=O
|
|
| MCULE-5752100798 |
0.70 |
C(=O)([C@@H](N)CC1C=CC=CC=1)N1CCC(CC1)C(=O)NCC(O)=O
|
|
| MCULE-5807258870 |
0.70 |
N1(CC(CC1C(NC)=O)OC1C=CC=CC=1)C(CCC1C=CC(=CC=1)OC)=O
|
|
| MCULE-4356862836 |
0.70 |
O=C(C12CC3CC(CC(C3)C1)C2)NC(C(N1CCC1)=O)CC1=CC=CC=C1
|
|
| MCULE-9504782763 |
0.70 |
C(C1C=CC(O)=CC=1)[C@H](N)C(N[C@H](CC(=O)N)C(N[C@@H](C(C)C)C(N[C@@H](C(NCC(N[C@@H](C(N[C@H](CCC(O)=O)C(N[C@H](CCC(O)=O)C(N[C@@H](C(C)C)C(N[C@@H](CCCCN)C(N[C@@H](C(O)=O)[C@H](C)CC)=O)=O)=O)=O)=O)[C@@H](C)CC)=O)=O)CC1C=CC(O)=CC=1)=O)=O)=O
|
|
| MCULE-7202439739 |
0.70 |
CCC(C1N(C(CN(C(C)=O)CCC2=CC=CC=C2)=O)CCCC1)O
|
|
| MCULE-9722931092 |
0.70 |
N1(C[C@H](C[C@H]1C(NC)=O)OC1C=CC=CC=1)C(CCC1C=CC(=CC=1)OC)=O
|
|
| MCULE-5544777273 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)NCCCC[C@H](N)C(N[C@H](C)C(=O)N[C@@H](CC1C3C=CC=CC=3NC=1)C(=O)N[C@H](CC(C)C)C2=O)=O)O
|
|
| MCULE-7296342358 |
0.70 |
C(C1C=CC(O)=CC=1)[C@H](N)C(N[C@H](CC(=O)N)C(N[C@@H](C(C)C)C(N[C@@H](C(NCC(N[C@@H](C(N[C@@H](CCC(O)=O)C(N[C@H](C(N[C@@H](C(C)C)C(N[C@@H](CCCCN)C(N[C@H](C(O)=O)[C@H](C)CC)=O)=O)=O)C)=O)=O)[C@@H](C)CC)=O)=O)CC1C=CC(O)=CC=1)=O)=O)=O
|
|
| MCULE-7993003196 |
0.70 |
N1(CC(CC1=O)C1=CC=CC=C1)CC(=O)N1CCC(CC1)F
|
|
| MCULE-4023205300 |
0.70 |
N1(CC(CC1C(=O)N1CCCC1)OC1=CC=CC=C1)C(CCC1C=CC(=CC=1)OC)=O
|
|
| MCULE-7533969376 |
0.70 |
C(NC1CC1)([C@@H](NC(=O)[C@H]1CC[C@@H](CC1)C(C)C)CC1C=CC=CC=1)=O
|
|
| MCULE-7590530795 |
0.70 |
N1(C[C@H](C[C@@H]1C(NC)=O)OC1C=CC=CC=1)C(CCC1C=CC(=CC=1)OC)=O
|
|
| MCULE-8611508697 |
0.70 |
C1=CC=C(C=C1)C1CC(=O)N(CC(=O)NC23CC4CC(CC(C4)C2)C3)C1
|
|
| MCULE-7326523064 |
0.70 |
CC(N1[C@@H](C(N2CC3(CCC3)C3=C(C=CC=C3)C2)=O)C[C@H](O)C1)=O
|
|
| MCULE-7867281320 |
0.70 |
C(=O)(NC1CC1)[C@@H](CC1C=CC=CC=1)NC(=O)[C@H]1CC[C@@H](CC1)C(C)C
|
|
| MCULE-5139750205 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(CCC1=CC=NC=C1)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-2592534440 |
0.70 |
N1(CCCC(O)(CN(C)C)C1)C(=O)CN1CCC(CC1)C1C=CC=CC=1
|
|
| MCULE-8339375036 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)[C@H]1CCC(=O)N1)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-6730629580 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)NCCCC[C@H](NC(C)=O)C(N[C@H](C)C(=O)N[C@@H](CC1C3C=CC=CC=3NC=1)C(=O)N[C@H](CC(C)C)C2=O)=O)O
|
|
| MCULE-1421058535 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(=O)C1=CC=CC(C3=CC=CC(F)=C3)=C1)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-1654495431 |
0.70 |
CN1CC(CO)N(C(CC(C2=CC=CC=C2)CC#N)=O)CC1
|
|
| MCULE-5877506816 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)CN1CCCC1=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-4346681507 |
0.70 |
CNC(CNC(C(NC(C12CC3CC(C1)CC(C3)C2)=O)CC1C=CC=CC=1)=O)C
|
|
| MCULE-7108617673 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(=O)C1=CC(F)=CC(Cl)=C1)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-4823193371 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)C1C=C(C)N=C(C)C=1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-6493500128 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)C1=CC=CC(=C1)OC(F)F)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-7866170003 |
0.70 |
N1(CC(=O)NC2C3CC4CC2CC(C4)C3)CC(CC1=O)C1C=CC=CC=1
|
|
| MCULE-1965114390 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)C1=CC=CN=C1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-5332985510 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)NCCCC[C@H](NC(CCC(C)C)=O)C(N[C@H](C)C(=O)N[C@@H](CC1C3C=CC=CC=3NC=1)C(=O)N[C@H](CC(C)C)C2=O)=O)O
|
|
| MCULE-2501226673 |
0.70 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)[C@@H]1CCC(=O)N1)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-9413632241 |
0.70 |
OC(CN(C(CNC(CCC1CCCC1)=O)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-5744099928 |
0.70 |
CC(N(CC(N1CC(CO)(CO)CC1)=O)CCC1=CC=CC=C1)=O
|
|
| MCULE-6105233489 |
0.70 |
O=C(C(NC(C1CCCCCC1)=O)CC1=CC=CC=C1)NC1CC1
|
|
| MCULE-6784893295 |
0.70 |
CC(CC(NC(C(N1CCN(C)CC1)=O)CC1=CC=CC=C1)=O)C
|
|
| MCULE-2539279156 |
0.70 |
N1(C[C@H](C[C@H]1C(=O)N1CCOCC1)OC1=CC=CC=C1)C(CCC1=CC=CC=C1)=O
|
|
| MCULE-4142524489 |
0.70 |
CCN1CCN(C(C(NC(CC)=O)CC2=CC=CC=C2)=O)CC1
|
|
| MCULE-8328957652 |
0.70 |
N1(C[C@H](C[C@H]1C(=O)NC1CC1)OC1=CC=CC=C1)C(=O)C1(C2=CC=CC=C2)CC1
|
|
| MCULE-8433175751 |
0.70 |
CCN1CCN(C(CC2CCN(C(C(CC3C=CC=CC=3)N)=O)CC2)=O)CC1
|
|
| MCULE-3377016190 |
0.70 |
N1(CC(CC1C(=O)NC1CC1)OC1C=CC=CC=1)C(CCC1C=CC(=CC=1)OC)=O
|
|
| MCULE-5311044649 |
0.70 |
C(=O)(CN1CCCCC1)NC(CC1C=CC=C(F)C=1)C(O)=O
|
|
| MCULE-5236628964 |
0.70 |
N1(C[C@H](C[C@@H]1C(=O)N1CCOCC1)OC1C=CC=CC=1)C(CCC1=CC=CC=C1)=O
|
|
| MCULE-6641889506 |
0.70 |
CC(C(C(N1CC(CC2=CC=C(F)C=C2)CC1)=O)NC(C1CC1)=O)O
|
|
| MCULE-2178199984 |
0.70 |
N1(C[C@H](C[C@H]1C(=O)N1CCCC1)OC1C=CC=CC=1)C(=O)C1(C2=CC=CC=C2)CC1
|
|
| MCULE-7364429859 |
0.70 |
CC(C(=O)O)N(C(C1C2C=CC=CC=2C1)=O)CCNC(=O)C
|
|
| MCULE-1051716474 |
0.70 |
N1(CC(CC1C(NC)=O)OC1=CC=CC=C1)C(=O)C1(C2=CC=CC=C2)CC1
|
|
| MCULE-3138734905 |
0.70 |
N1(CC(CC1=O)C1=CC=CC=C1)CC(=O)N1CCC(CC1)C1=CC=CC(=C1)C#N
|
|
| MCULE-9170270557 |
0.70 |
N1(CC(CC1C(NCCOC)=O)OC1=CC=CC=C1)C(=O)C1(C2=CC=CC=C2)CC1
|
|
| MCULE-2281024183 |
0.70 |
C(=O)(C(CC(C)C)[NH3+])NC(CC1C=CC=CC=1)C(OC)=O.[Cl-]
|
|
| MCULE-9873311833 |
0.70 |
N1(C[C@H](C[C@H]1C(NCCOC)=O)OC1=CC=CC=C1)C(=O)C1(C2=CC=CC=C2)CC1
|
|
| MCULE-4597972908 |
0.70 |
CC(C1CC1)(CNC([C@@H](NC(CC1=CC=C(F)C=C1)=O)CO)=O)O
|
|
| MCULE-9917789612 |
0.70 |
N1(C[C@H](C[C@H]1C(NC)=O)OC1=CC=CC=C1)C(=O)C1(C2=CC=CC=C2)CC1
|
|
| MCULE-9102337217 |
0.70 |
CCC(C1C=CC=CC=1)(C(N(CC(N1CC(C(=O)O)CCC1)=O)C)=O)CC
|
|
| MCULE-1239698190 |
0.70 |
N1(CC(CC1C(=O)N1CCOCC1)OC1=CC=CC=C1)C(CCC1=CC=CC=C1)=O
|
|
| MCULE-3277542753 |
0.70 |
C1(CCCN(CCC2C=CC=CC=2)C1=O)(O)CN1CCCNC(=O)C1
|
|
| MCULE-4803869954 |
0.70 |
N1(C[C@H](C[C@H]1C(=O)NC1CC1)OC1C=CC=CC=1)C(CCC1C=CC(=CC=1)OC)=O
|
|
| MCULE-4322937406 |
0.70 |
C(=O)(CN1CCC(CC1)C)NC(CC1C=CC=C(F)C=1)C(O)=O
|
|
| MCULE-5642674562 |
0.70 |
N1(CC(CC1C(=O)N1CCCC1)OC1C=CC=CC=1)C(=O)C1(C2=CC=CC=C2)CC1
|
|
| MCULE-3783058601 |
0.70 |
CN(C(C1(C2C=CC=CC=2)CC1)=O)CC(N1CC(C(=O)O)CCC1)=O
|
|
| MCULE-8710420576 |
0.70 |
C(CCNC(N)=N)[C@@H](C(N1[C@@H](CCC1)C(N[C@H](CCCCN)C(N[C@H](CCCNC(N)=N)C(N1[C@@H](CCC1)C(N[C@H]([C@@H](O)C)C(N[C@H]([C@H](O)C)C(N[C@H](CC(C)C)C(N[C@@H](CC(=O)N)C(N[C@@H](CC(C)C)C(N[C@@H](C(N)=O)CC1C=CC=CC=1)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)N
|
|
| MCULE-8796938163 |
0.70 |
OC1CC(C(N2CCC(CC3C=CC=C(F)C=3)CC2)=O)NC1
|
|
| MCULE-4159640456 |
0.70 |
N1(CC(CC1C(=O)NC1CC1)OC1=CC=CC=C1)C(=O)C1(C2=CC=CC=C2)CC1
|
|
| MCULE-4689206471 |
0.70 |
CC(C(C1C=CC=CC=1)C(N(CC(N1CC(C(=O)O)CCC1)=O)C)=O)C
|
|
| MCULE-1093122913 |
0.70 |
C1(CC2C(=CC=CC=2)C1)(N1CCN(CC1)CC)C(=O)N1CCCC(OC)C1
|
|
| MCULE-2227996014 |
0.70 |
CCC(C1C=CC=CC=1)C(N(CC(N1CC(C(=O)O)CCC1)=O)C)=O
|
|
| MCULE-2143915232 |
0.70 |
CNC(C1(N(C(C2(CC2)CC2=CC=C(F)C=C2)=O)CCC1)COC)=O
|
|
| MCULE-5417749008 |
0.70 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(=O)C1CC2=C(C=CC=C2)C1)C
|
|
| MCULE-3163160737 |
0.70 |
CO[C@H]1C[C@H](C(NCC(C2=CC=CC=C2)N2CCC(C)CC2)=O)NC1
|
|
| MCULE-3878311444 |
0.70 |
CN(C([C@@H]1N[C@H](C(O)=O)CC1)=O)C1CC(C2=CC=CC=C2)C1
|
|
| MCULE-5135879046 |
0.70 |
OC(CN1C(=O)C(NC(C2(C3=CC=CC=C3)CNCC2)=O)CCCC1)=O
|
|
| MCULE-6509827393 |
0.70 |
COC(C(NC(C1(CCC1)N)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-1563607454 |
0.70 |
C(=O)([C@H](C(C)C)NC(=O)C(C1C=CC=CC=1)C1=CC=CC=C1)N1CCC[C@H]1CO
|
|
| MCULE-6911170738 |
0.70 |
CN(C(C(CC1C=CC=CC=1)(C)C)=O)CC(N1CCC(C(=O)O)CC1)=O
|
|
| MCULE-7995003368 |
0.70 |
C1(CCCN(CCCC2C=CC=CC=2)C1=O)(O)CN1CCN(CC1)C(C)=O
|
|
| MCULE-2272239461 |
0.70 |
CC(C1C=CC=CC=1)CC(N(CC(N1CCC(C(=O)O)CC1)=O)C)=O
|
|
| MCULE-1355105941 |
0.70 |
CCCC(C(=O)O)NCC(NCC1(C2C=CC=CC=2)CCCC1)=O
|
|
| MCULE-5002497055 |
0.70 |
COCCNCC(N1C(C)C(C2=CC=CC=C2)CC1)=O
|
|
| MCULE-8582085607 |
0.70 |
NC([C@]1(NC([C@H]2[C@@]3(C4=CC=CC=C4)CC[C@@H]2C3)=O)C[C@@H](O)C1)=O
|
|
| MCULE-2013064727 |
0.70 |
CC1N(C)C(=O)C(C)N(C(CC(C2=CC=CC=C2)(O)C)=O)C1C
|
|
| MCULE-9362598969 |
0.70 |
C1(=O)N(CCCC1(CNCC(N)=O)O)CCCC1C=CC=CC=1
|
|
| MCULE-4652561487 |
0.70 |
CN(C(CCC1C=CC=CC=1)=O)CC(N1CCC(C(=O)O)CC1)=O
|
|
| MCULE-9680171068 |
0.70 |
N12CCN(C[C@@H]1C(=O)N[C@@H]([C@@H](C)O)C2=O)CCCC1C=CC=CC=1
|
|
| MCULE-5569112585 |
0.70 |
CC1=CC(CC(NC(CN2CCC(CO)CC2)=O)CO)=CC=C1
|
|
| MCULE-1174481760 |
0.70 |
CCCC(C(=O)O)NCC(N1CCC(NC(CCC2C=CC=CC=2)=O)CC1)=O
|
|
| MCULE-9808954043 |
0.70 |
CN1CCN(C(CN2CC(C3=CC=CC=C3)(CO)CC2)=O)CC1
|
|
| MCULE-2795373483 |
0.70 |
C(=O)(N[C@@H](C)[C@H](O)C1=CC=CC=C1)C1(CCCCC1)N1CCCCC1
|
|
| MCULE-3218121455 |
0.70 |
N1(C[C@H](CC2=CC=CC=C2)NC(=O)C1)C(=O)CC(C1=CC=CC=C1)C1=CC=CC=C1
|
|
| MCULE-3061237845 |
0.70 |
C(=O)(C(C(C)C)NC(=O)C(C1C=CC=CC=1)C1=CC=CC=C1)N1CCCC1CO
|
|
| MCULE-8947984313 |
0.70 |
CN(C(CC(C1C=CC=CC=1)(C)C)=O)CC(N1CCC(C(=O)O)CC1)=O
|
|
| MCULE-3694623186 |
0.70 |
COCC1(CCNCC1)CNC(CNC(CCC1C=CC(C)=CC=1)=O)=O
|
|
| MCULE-4422975558 |
0.70 |
CC(C(=O)O)N(C(CNC(CCC1C=CC(C)=CC=1)=O)=O)C1CC1
|
|
| MCULE-9655286721 |
0.70 |
COCC(N[C@H](C(NCC1(C2=CC=CC=C2)CCC1)=O)C(C)C)=O
|
|
| MCULE-7457665255 |
0.70 |
C1=CC=CC=C1C[C@H]1CN2CCCC[C@@]2([H])C(=O)N1
|
|
| MCULE-3173596873 |
0.70 |
CC(C[C@@H](C(=O)O)NC(CNC(C1(C2C=CC=C(C)C=2)CC1)=O)=O)C
|
|
| MCULE-9783377198 |
0.70 |
CC1C=CC(CCC(NCC(NC2(C(=O)O)CC2)=O)=O)=CC=1
|
|
| MCULE-3435828864 |
0.70 |
CC(C[C@@H](C(=O)O)NC(CNC(C1(C2C=C(C)C=C(C)C=2)CC1)=O)=O)C
|
|
| MCULE-9235373511 |
0.70 |
Cl.OC1CC(C(NCCC2=C(Cl)C=C(Cl)C=C2)=O)NC1
|
|
| MCULE-7486911363 |
0.70 |
N1(C[C@H](CC)NC(=O)[C@H](CC2C=CC=CC=2)NC([C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C1)=O)C(=O)C1CC2=C(C=CC=C2)C1
|
|
| MCULE-6999180851 |
0.70 |
COC(C(NC(C1C(C)(C)CCCN1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-5789681969 |
0.70 |
N1(CC(O)=O)C[C@@H]([C@@H](C2CC2)C1)NC(CCC1=CC=CC=C1)=O
|
|
| MCULE-5230665568 |
0.70 |
[C@H]1(CN(C[C@H]1C1C=CC(=CC=1)F)CC(=O)N1CCCCC1)C(O)=O
|
|
| MCULE-6309827839 |
0.70 |
COCC(N(CC(N1C(C)C(C2=CC=CC=C2)CC1C)=O)C)=O
|
|
| MCULE-6392347359 |
0.70 |
COC1=CC(CCNC(C2NCC(O)C2)=O)=CC=C1
|
|
| MCULE-8613960435 |
0.70 |
CCCC(C(N1CCC(C(=O)O)(O)CC1)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-2826674765 |
0.70 |
N1(CC)C(C(NCCOC)=O)CC2(CCN(CC2)C(CCC2=CC=CC=C2)=O)C1=O
|
|
| MCULE-9957807633 |
0.70 |
OC1CN([C@@H]2[C@H](NC(C3CC4=C(C=CC=C4)C3)=O)CCC2)CC1
|
|
| MCULE-1432581510 |
0.70 |
C(=O)(N[C@H]1CN(C[C@@H]1C1C=CC=CC=1)CC(NC)=O)C1(CCC1)COC
|
|
| MCULE-6548456110 |
0.70 |
CC[C@@H]([C@@H](C(=O)O)NCC(NCC1(C2C=CC=CC=2)CCCC1)=O)C
|
|
| MCULE-2076789967 |
0.70 |
CC(CCC(NCC(NC(C(=O)O)CC1C=C(Cl)C=C(Cl)C=1)=O)=O)C
|
|
| MCULE-3038954609 |
0.70 |
C1(=O)N(CCCC1(CNCC(N)=O)O)CCC1=CC=CC=C1
|
|
| MCULE-3706055967 |
0.70 |
N1C[C@@H](C[C@@H]1C(NCCC1=CC=C(C=C1Cl)Cl)=O)O
|
|
| MCULE-7646726243 |
0.70 |
OC([C@H]1N(CC(NCCC(C2=CC=CC=C2)C2=CC=CC=C2)=O)CCC1)=O.Cl
|
|
| MCULE-2031224281 |
0.70 |
CN(C(CN1C(=O)C(O)CCCC1)=O)C1CC2=C(C=CC=C2)C1
|
|
| MCULE-3589824705 |
0.70 |
N12C[C@H](C[C@H]1C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)NCCC1C=CC(=CC=1)OCC(=O)N[C@@H](CC1C=CC=CC=1)C2=O)N
|
|
| MCULE-1675625363 |
0.70 |
CC(OC1C=CC(CCNC(C2(N(C)CC(O)C2)C)=O)=CC=1)C
|
|
| MCULE-8595764286 |
0.70 |
C(=O)([C@H](C(C)C)NC(=O)[C@H](CC(O)=O)NC(=O)[C@H](CCCCN)NC([C@H](CCCNC(N)=N)N)=O)N[C@@H](CC1C=CC(=CC=1)O)C(O)=O
|
|
| MCULE-9914977673 |
0.70 |
N1[C@@H](CC2=CC=C(C=C2)OC)C(=O)N[C@@H](CCCN)C1=O
|
|
| MCULE-6110259506 |
0.70 |
CC(C(N1C2=C(C=CC=C2)CC1C)=O)NC([C@@H]1N(C(C)=O)C[C@@H](O)C1)=O
|
|
| MCULE-8139132638 |
0.70 |
OC1C(=O)N(CC(NC2CC3=C(C=CC=C3)C2)=O)CCCC1
|
|
| MCULE-9870411852 |
0.70 |
[C@@H](CC(=O)O)(NC(=O)[C@H](CCCCN)NC(=O)[C@@H](N)CCCNC(=N)N)C(=O)N[C@@H](C(C)C)C(=O)N[C@H](C(=O)O)CC1=CC=C(O)C=C1
|
|
| MCULE-8821466243 |
0.70 |
COC(C(NC(C1NCCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-7852775899 |
0.70 |
C(CCNC(N)=N)[C@@H](C(N[C@H](CCCCN)C(N[C@@H](C(N[C@H](C(C)C)C(N[C@@H](C(O)=O)CC1C=CC(O)=CC=1)=O)=O)CC(O)=O)=O)=O)N
|
|
| MCULE-3467774661 |
0.70 |
COC(C(NC(C1(NCCCC1)C)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-2420220252 |
0.70 |
N1(CCCNC(=O)[C@H](CC2=CC=CC=C2)NC(CN(C)C(=O)[C@H](C(C)C)NC(=O)[C@H]1C)=O)C(=O)[C@H]1CCCO1
|
|
| MCULE-2787579489 |
0.70 |
N1(CC2CCCCC2)C(=O)CC(C2C=CC=CC=2)(CC(=O)N2CCN(CC2)CCO)C1=O
|
|
| MCULE-5743690711 |
0.70 |
N1(C[C@@H]2C[C@@H](CN2C(=O)[C@@H]1CC1C=CC=CC=1)OC)C(=O)CN1C=CN=C1
|
|
| MCULE-6519435902 |
0.70 |
CC(C(C1=CC=C(F)C=C1)O)NC(CN1C(=O)CCCCCC1)=O
|
|
| MCULE-3647815980 |
0.70 |
C1(=O)[C@@H]2CCCN2C(=O)CN(C[C@H]2OCC[C@@H]([C@@H]2O)NC(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@H](C)N1C)C(=O)[C@H]1CCCO1
|
|
| MCULE-7962824106 |
0.70 |
CC(C1=C(C)C=CC=C1)CC(N1C(C(N2CCOCC2)=O)CCC1)=O
|
|
| MCULE-5345400283 |
0.70 |
N12C[C@H](C[C@H]1CN([C@@H](CC1C=CC=CC=1)C2=O)CC1C=CSC=1)OC
|
|
| MCULE-8474002378 |
0.70 |
OC1CC(C(NCCC2=C(Cl)C=C(Cl)C=C2)=O)NC1
|
|
| MCULE-8632261932 |
0.70 |
C1(N(C)CCC2=CC=CC=C2)(CC2C(=CC=CC=2)C1)C(=O)NCC1(CCC1)CO
|
|
| MCULE-7216266104 |
0.70 |
OC1CC(C(NCCC2C=CC=C(Cl)C=2Cl)=O)NC1
|
|
| MCULE-7876848572 |
0.70 |
N1[C@@H](CC(C)C)C(=O)N[C@@H](CC2=CC=C(C=C2)OC)C1=O
|
|
| MCULE-2406338907 |
0.70 |
COC(C(NC(C1NCCC(C)C1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-8420142090 |
0.70 |
OCC1(C2=CC=CC=C2)CN(C(C23CCCN2CCC3)=O)CCC1
|
|
| MCULE-1840296184 |
0.70 |
C[C@H]1O[C@@H](C)CN(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)CC1
|
|
| MCULE-6930713648 |
0.70 |
CC(C(N1C(C(C2=CC=CC=C2)O)CCCC1)=O)NC(C)=O
|
|
| MCULE-9438134664 |
0.70 |
CC1OC(CO)CN(C(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)C1
|
|
| MCULE-4072790882 |
0.70 |
CC(C[C@@H](C(=O)O)NC(CNC(C1(C2C=CC=CC=2)CCCC1)=O)=O)C
|
|
| MCULE-6777217072 |
0.70 |
CO[C@@H]1CN(C(C)=O)[C@@H](C(NCCC2=C3C(C=CC=C3)=CC=C2OC)=O)C1
|
|
| MCULE-7010614944 |
0.70 |
CN(C(C(NCC1(N2CCCCC2)CCOCC1)=O)CC1=CC=CC=C1)C
|
|
| MCULE-6380949856 |
0.70 |
C(C)(C)[C@H](NC)C(N[C@H](C(N([C@@H]([C@@H](C)CC)[C@H](OC)CC(N1[C@]([H])([C@H](OC)[C@@H](C)C(=O)N[C@H](C(O)=O)CC2C=CC=CC=2)CCC1)=O)C)=O)C(C)C)=O.Cl
|
|
| MCULE-5292917518 |
0.70 |
O[C@@H]1C[C@H](C(N2CCC(CC3=CC=C(Cl)C=C3)CC2)=O)NC1
|
|
| MCULE-9291204936 |
0.70 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(N2CCOCCC2)=O)C1
|
|
| MCULE-6167928732 |
0.70 |
CO[C@@H]1CN(C)[C@H](C(NCC2CC(C3=CC=CC=C3)C2)=O)C1
|
|
| MCULE-4875538449 |
0.70 |
N12C[C@H](C[C@H]1CN(CC2=O)C(=O)CCC1=CC=CC=C1OC)OC
|
|
| MCULE-4112250516 |
0.70 |
N1[C@@H]([C@@H](C)CC)C(=O)N[C@@H](CC2=CC=C(C=C2)OC)C1=O
|
|
| MCULE-2409651211 |
0.70 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(N2CC(C3COCC3)CC2)=O)C1
|
|
| MCULE-5568828757 |
0.70 |
[C@@H](NC(=O)[C@H](CC(C)C)N)(C(OC)=O)CC1C=CC=CC=1.C(C(O)=O)(F)(F)F
|
|
| MCULE-8798341039 |
0.70 |
C12(CC1)C(=O)NCCOC1=CC=C(C=C1)C[C@@H](C(=O)N[C@@H](C)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N2)NC(=O)[C@@H]1CCC(=O)N1
|
|
| MCULE-5876301938 |
0.70 |
COC1=CC=C(CC(C(N2[C@@H](CO)CN3[C@@H](CCC3)C2)=O)C)C=C1
|
|
| MCULE-3435471361 |
0.70 |
N12C[C@H](C[C@H]1CN([C@@H](CC1=CC=CC=C1)C2=O)C(=O)CCN1C=CN=C1)OC
|
|
| MCULE-3268230136 |
0.70 |
CC1C=CC(CCC(NCC(N2C(CC(=O)O)CCC2)=O)=O)=CC=1
|
|
| MCULE-1722848680 |
0.70 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC(=O)CN1C=CN=C1
|
|
| MCULE-3138380166 |
0.70 |
COC1(C2=CC=CC=C2)CN(C(C2N(C(C)=O)CCC2)=O)C1
|
|
| MCULE-6609285116 |
0.70 |
CCCC(CC(N(C(C(=O)O)CC1C=CC=CC=1)C)=O)(CCC)O
|
|
| MCULE-1118297988 |
0.70 |
COC1=CC=C(CCC(N2[C@@H](CO)CN3[C@@H](CCC3)C2)=O)C=C1
|
|
| MCULE-8846312816 |
0.70 |
CNC(C(NC([C@@H](C1=CC=CC=C1)O)=O)CC(C)C)=O
|
|
| MCULE-6696832770 |
0.70 |
C[C@H]1N(C(CNC(CCC2C=CC(C)=CC=2)=O)=O)CCC[C@H]1C(=O)O
|
|
| MCULE-4438858161 |
0.70 |
CC1CN(CC(NCC2(C3C=CC=CC=3)CC2)=O)CC(C(=O)O)C1
|
|
| MCULE-8752479768 |
0.70 |
COC(C(NC(CN1CCN(CC(N2CCCCC2)=O)CC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-7115004977 |
0.70 |
NCCCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](CC2C=CC=CC=2)C(=O)N1.OC(C(F)(F)F)=O
|
|
| MCULE-8419891087 |
0.70 |
N1(CC(CC1=O)C1=CC=CC=C1)CC(=O)N1CCC(CC1)OCC1C=CC=CC=1
|
|
| MCULE-9672707055 |
0.70 |
N1(C)C[C@@H](C[C@H]1CO)NC(=O)CC(C)(C)C1C=CC=CC=1
|
|
| MCULE-4457241819 |
0.70 |
OC(C(NC(C1(CCC1)CC1C=CC=CC=1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-1207432804 |
0.70 |
C(C1C=CC=CC=1)[C@@H](N)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](C(C)C)C(N[C@H](C(N[C@H](CCC(O)=O)C(N[C@H](CCC(O)=O)C(N[C@@H](C(N[C@@H](CCC(N)=O)C(N[C@@H](CO)C(N1[C@H](CCC1)C(N[C@@H](C(N[C@@H](C(N[C@H](CO)C(N[C@@H](CCC(N)=O)C(N[C@@H](CO)C(N[C@H](CCCNC(N)=N)C(NCC(N[C@@H](C(N[C@@H](C(N[C@@H](CC(C)C)C(N[C@H](C(N[C@@H](CCCNC(N)=N)C(N1[C@H](CCC1)C(N[C@H](CCCNC(N)=N)C(N[C@H](CC(=O)N)C(N)=O)=O)=O)=O)=O)CC1C=CC=CC=1)=O)=O)CC1C=CC=CC=1)=O)CC1C=CC(O)=CC=1)=O)=O)=O)=O)=O)=O)C)=O)CC1C=CC=CC=1)=O)=O)=O)=O)CC1C=CC=CC=1)=O)=O)=O)CC(O)=O)=O)=O)=O
|
|
| MCULE-9086263200 |
0.70 |
CC1(N(CCO)CCN(C([C@]2(C3=CC=CC=C3)C[C@H](O)C2)=O)C1)C
|
|
| MCULE-4523919962 |
0.70 |
CCNC([C@H](C(C)C)NC([C@]1(C2=CC=CC=C2)C[C@H](O)C1)=O)=O
|
|
| MCULE-3723370541 |
0.70 |
O[C@H]1[C@H](CC(N2CC(CC3=CC=CC=C3)NCC2)=O)CCC1
|
|
| MCULE-3417318565 |
0.70 |
OC(CN1C(=O)C(N2CCC(C3=C4C(C=CC=C4)=CC=C3)CC2)CCCC1)=O
|
|
| MCULE-8932992881 |
0.70 |
NC(NCCCCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)=O
|
|
| MCULE-4877601472 |
0.70 |
N1(CCCNC(=O)[C@H](CC2=CC=CC=C2)NC(CN(C)C(=O)[C@H](C(C)C)NC(=O)[C@H]1C)=O)C(C1CCC1)=O
|
|
| MCULE-7602763070 |
0.70 |
CC(C(N1C(C(=O)O)CCC1)=O)N1CCC(CC2C=CC=CC=2)CC1
|
|
| MCULE-7084424267 |
0.70 |
O=C(N1C(CC2=CC=CC=C2)C(=O)NCCC1)C[C@@H]1COCC1
|
|
| MCULE-4751694367 |
0.70 |
N1(C[C@H]([C@H](C(O)=O)C1)C1=CC=C(C=C1)F)C(=O)CN1CCCCCCC1
|
|
| MCULE-2243420606 |
0.70 |
OC(C1CCN(C(C2N(C(CC3C=CC=CC=3)=O)CCC2)=O)CC1)=O
|
|
| MCULE-4269427546 |
0.70 |
NCCCCNC(C(NC(C12CC3CC(CC(C3)C1)C2)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-9762048843 |
0.70 |
OC(C1CN(CC(NCC2(C3C=CC=CC=3)CC2)=O)CCC1)=O
|
|
| MCULE-8371746620 |
0.70 |
N1(CC(N)=O)C[C@@H]([C@@H](C2C=CC=CC=2)C1)NC(=O)CN1CCCCC1=O
|
|
| MCULE-2387499015 |
0.70 |
[C@@H]1(C(O)=O)CN(C[C@H]1C1C=CC=CC=1C)C(=O)CN1CCCCC1
|
|
| MCULE-1028373209 |
0.70 |
OC[C@@H](NC(C1N(C2CCCC2)CC1)=O)CC1=CC=CC=C1
|
|
| MCULE-5110037566 |
0.70 |
NC(C(N1CC(C(F)(F)F)(O)CC1)=O)CC1C=CC=CC=1
|
|
| MCULE-6125773432 |
0.70 |
CCCC(CC(NC(C(=O)O)CC1C=CC=CC=1)=O)(CCC)O
|
|
| MCULE-3043675871 |
0.70 |
C(C(O)=O)(F)(F)F.C1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC2C=CC=CC=2)NC(=O)[C@H](CC(=O)O)NC1=O
|
|
| MCULE-2263178145 |
0.70 |
COC1CC(C(N[C@@H](C(O)=O)CC2=CC=CC=C2)=O)C1
|
|
| MCULE-8776327773 |
0.70 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)CC1=C(C=CC=C1F)Cl)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
|
|
| MCULE-2239782878 |
0.70 |
O[C@@H]1C[C@](C(=O)N[C@H](C(N)=O)CC2C=CC(=CC=2)OC)(C[C@@H]([C@H]1O)NC([C@H](C(C)C)NC)=O)O
|
|
| MCULE-6244962481 |
0.70 |
N12C[C@@H](CC1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)=O)NC(CC1C=CC(=CC=1)Cl)=O
|
|
| MCULE-3501138601 |
0.70 |
C12CN(C(=O)CC3CCCCC3)C(C(=O)N1CCN(CCOC)C2=O)CC1C=CC=CC=1
|
|
| MCULE-2424442660 |
0.70 |
CO[C@@H]1CN(C)[C@H](C(NCC2(C3=C(Cl)C=CC=C3)CC2)=O)C1
|
|
| MCULE-6481576489 |
0.70 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2C=CC=CC=2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(=O)CC1C=C(F)C=CC=1F
|
|
| MCULE-7547018892 |
0.70 |
[C@@H]12CN(C(=O)CC3CCCCC3)[C@H](C(=O)N1CCN(CCOC)C2=O)CC1C=CC=CC=1
|
|
| MCULE-6617042127 |
0.70 |
OC1CC(C(NCC2(C3C=CC=C(Br)C=3)CCOCC2)=O)NC1
|
|
| MCULE-9324228093 |
0.70 |
CC(N1[C@@H](C(NC2(C3=CC=C(C(C)(C)C)C=C3)CCCC2)=O)C[C@@H](O)C1)=O
|
|
| MCULE-1032528509 |
0.70 |
[C@@H]12CN(C(=O)CC3CCCC3)[C@H](C(=O)N1CCN(CCOC)C2=O)CC1C=CC=CC=1
|
|
| MCULE-6342178667 |
0.70 |
N12C[C@H](C[C@H]1CN(CC2=O)C(NCCC1C=CC=CC=1)=O)OC
|
|
| MCULE-9959625659 |
0.70 |
N1(CC(CC1=O)C1=CC=CC=C1)CC(=O)N1CCOC2(CCCC2)C1
|
|
| MCULE-2786409161 |
0.70 |
[C@@H]12CN(C(CCC3CCCC3)=O)[C@H](C(=O)N1CCN(CCOC)C2=O)CC1=CC=CC=C1
|
|
| MCULE-9585088349 |
0.70 |
C12CN(C(CCC3CCCC3)=O)C(C(=O)N1CCN(CCOC)C2=O)CC1=CC=CC=C1
|
|
| MCULE-9165671778 |
0.70 |
CC(N1[C@@H](C(NC2(C3=CC(C)=CC=C3)CCCC2)=O)C[C@@H](O)C1)=O
|
|
| MCULE-6165263980 |
0.70 |
N1(C[C@@H](C[C@H]1C(N)=O)O)C1CCN(CC1)C(CCCC1C=CC=CC=1)=O
|
|
| MCULE-8517626688 |
0.70 |
CC(C(NCC(C(=O)O)CC1C=CC=CC=1)=O)NC(C1CCCC1)=O
|
|
| MCULE-3993946620 |
0.70 |
OC(C(CC1C=CC=CC=1)CNC(CN1C(=O)CCCCC1)=O)=O
|
|
| MCULE-6204607392 |
0.70 |
[C@@H]1(CN(C[C@@H]1C1=CC=CC=C1)CCO)NC(=O)CCN1CCCCC1=O
|
|
| MCULE-9530400824 |
0.70 |
C1(N(C)CCC2=CC=CC=C2)(CC2C(=CC=CC=2)C1)C(=O)NCC(CC)O
|
|
| MCULE-1518072321 |
0.70 |
N1(C[C@@H]([C@@H](N2CCCCC2)C1)O)C(CCC1=CC=C(C(C)=C1)C)=O
|
|
| MCULE-7876565688 |
0.70 |
N1(CCC2=CC=C(C=C2)C)C(=O)CCC1(C)C(NCCOC)=O
|
|
| MCULE-2260484409 |
0.70 |
CC1C=CC=C(CC(C(=O)O)CNC(CNC(CC2C=CC=CC=2)=O)=O)C=1
|
|
| MCULE-9714079758 |
0.70 |
N1(C[C@H](CC2C=CC=CC=2)NC(=O)C1)C(=O)CC1CCN(CC1)CC1=CC=CC=C1
|
|
| MCULE-7432847977 |
0.70 |
OC(C(CC1C=CC=CC=1)CNC(CN1C(=O)CCCCCC1)=O)=O
|
|
| MCULE-2802665611 |
0.70 |
C1C(O)=CC=C(C[C@H](C(N[C@@H](C(NCCCCCC(N)=O)=O)[C@@H](CC)C)=O)NC(CCCCC)=O)C=1
|
|
| MCULE-8717212540 |
0.70 |
COCCC(C(=O)O)NC(C(C(C)C)NC(CC1C=CC=CC=1)=O)=O
|
|
| MCULE-7161318681 |
0.70 |
OC(C1N(CC(NCCCC2C=CC=CC=2)=O)C2C(CCCC2)C1)=O
|
|
| MCULE-5958555692 |
0.70 |
C1(N(C)CCC2C=CC=CC=2)(CC2C(=CC=CC=2)C1)C(=O)NC(CO)C(C)C
|
|
| MCULE-3776473040 |
0.70 |
CCCC(N1C(C(NCC(C(=O)O)CC2C=CC=CC=2)=O)CCCC1)=O
|
|
| MCULE-1274863703 |
0.70 |
C1C=C(C[C@H](NC(=O)CCCCC)C(=O)N[C@H](C(NCCCCCC(=O)N)=O)[C@@H](C)CC)C=CC=1O
|
|
| MCULE-2216121181 |
0.70 |
CCCC(C(N1CC(C(=O)O)CC1)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-1061651922 |
0.70 |
CCCC(C(N1CC(C(=O)O)(C)CC1)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-3338942908 |
0.70 |
CC(C(C(N1C(C)CC(C2=CC=CC=C2)C1)=O)NC1CCOCC1)C
|
|
| MCULE-9036104020 |
0.70 |
C1(N(C)CCC2=CC=CC=C2)(CC2C(=CC=CC=2)C1)C(=O)NC(CC)CO
|
|
| MCULE-6789734054 |
0.70 |
CC([C@@H](C(NCC(N(C1COCC1)CCC1C=CC=CC=1)=O)=O)N)C
|
|
| MCULE-8161468458 |
0.70 |
CCCC(C(N1C(C)C(C(=O)O)CC1)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-3394043089 |
0.70 |
CCCC(C(N1CC(C(=O)O)(C(C)C)CC1)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-7186710911 |
0.70 |
COC(C(NC(C(CC1C=CC=CC=1)N)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-9329928300 |
0.70 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)NCCN(C(=O)CC2C=CC(=CC=2)F)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-8832899300 |
0.70 |
CC(C1=CC=CC=C1)CNC(C1N(C(C)=O)CCC1)=O
|
|
| MCULE-2775249413 |
0.70 |
CC(C1=CC=CC=C1)CNC(C(N1C[C@H](O)CC1)C)=O
|
|
| MCULE-7690446799 |
0.70 |
CC(C(C1C=CC=CC=1)CNC(C1NCCC1)=O)C
|
|
| MCULE-1065039892 |
0.70 |
N1(CC(NCCC2=CC=CC=C2)=O)C[C@](C(C)(C)C1)(C)O
|
|
| MCULE-7105149450 |
0.70 |
CC(C(N1C(C(NCCC2=CC=CC=C2)=O)CCC1)=O)C
|
|
| MCULE-9631743173 |
0.70 |
CCC(C1C=CC=CC=1)(CNC(C1NCCC1)=O)CC
|
|
| MCULE-7236156762 |
0.70 |
CCCC(N1C(C(NCCC(C2=CC=CC=C2)C)=O)CCC1)=O
|
|
| MCULE-1525622570 |
0.70 |
CC(N1C(C(NCCC2=CC=CC=C2)=O)CCC1)=O
|
|
| MCULE-8734849649 |
0.70 |
CC(N1C(C(NCC(C2=CC=CC=C2)(C)C)=O)CCC1)=O
|
|
| MCULE-2710761246 |
0.70 |
CCC(C1C=CC=CC=1)CNC(C1NCCC1)=O
|
|
| MCULE-1191345218 |
0.70 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(COCC1=CC=CC=C1)=O)C
|
|
| MCULE-2017930710 |
0.70 |
CC(OC(N1C(C(NCCCC2=CC=CC=C2)=O)CC(O)C1)=O)(C)C
|
|
| MCULE-4743227105 |
0.70 |
C(=O)(C1(C2=CC=CC=C2)CCN(CC1)C(=O)OC(C)(C)C)N1CCCC1C(=O)NC(C(C)C)C(O)=O
|
|
| MCULE-5805459851 |
0.70 |
NC([C@H]1N(C([C@H]2[C@H](C3=CC=C(OC(F)F)C=C3)C2)=O)C[C@H](O)C1)=O
|
|
| MCULE-2175732724 |
0.70 |
C(=O)(C1(C2=CC=CC=C2)CCN(CC1)C(=O)OC(C)(C)C)N1CCC[C@H]1C(=O)N[C@H](C(C)C)C(O)=O
|
|
| MCULE-9713244981 |
0.70 |
CCC(C(C(N1C[C@@H](C2C=CC=CC=2)[C@H](N)C1)=O)N1CCOCC1)CC
|
|
| MCULE-3006359523 |
0.70 |
N1(C(=O)[C@@H](N[C@H](C(O)=O)CCC2=CC=CC=C2)C)[C@H](C(O)=O)C[C@@]2([H])CCCC[C@]12[H]
|
|
| MCULE-3394931831 |
0.70 |
CCN(C(C=C)=O)CC(N1CC(C2=CC=C(C)C=C2)(O)CC1)=O
|
|
| MCULE-1428120386 |
0.70 |
CC(C(C1C=CC=CC=1)CC(N1[C@H](C(=O)O)CCC1)=O)C
|
|
| MCULE-2891774411 |
0.70 |
CC(C(N(C(C(=O)O)C)CCNC(=O)C)=O)CC1C=CC(C)=CC=1
|
|
| MCULE-4119864832 |
0.70 |
OC([C@H](NC(CC1CC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-2387217178 |
0.70 |
CCC1C=CC(C(CC(N(C(C(=O)O)C)CCNC(=O)C)=O)C)=CC=1
|
|
| MCULE-2950929129 |
0.70 |
CCC(C1C=CC=CC=1)CC(N1C(C(=O)O)(C)CCC1)=O
|
|
| MCULE-6536389776 |
0.70 |
CCCC(C(NC(C(=O)O)CC1C=CC=CC=1)=O)C(C)C
|
|
| MCULE-4180529045 |
0.70 |
N1(CCNC(=O)[C@@H]1CC1=CC=CC=C1)CC1CCCC1
|
|
| MCULE-3714451717 |
0.70 |
CC(C1C=CC=CC=1)(CC(N1C(C(=O)O)CCC1)=O)C
|
|
| MCULE-4586186001 |
0.70 |
CC(C(=O)O)N(C(CCC1C=CC(C(C)(C)C)=CC=1)=O)CCNC(=O)C
|
|
| MCULE-7800404212 |
0.70 |
CC(C(C1C=CC=CC=1)CC(N1C(C(=O)O)(C)CCC1)=O)C
|
|
| MCULE-5312682277 |
0.70 |
CC(C1C=CC(C(CC(N(C(C(=O)O)C)CCNC(=O)C)=O)C)=CC=1)C
|
|
| MCULE-9763961820 |
0.70 |
CCC1=CC=C(CCC(N2C(C(NC3CC3)=O)CCC2)=O)C=C1
|
|
| MCULE-3520252027 |
0.70 |
N1(CCC[C@@H]1C(O)=O)C(CCC1C=CC=CC=1)=O
|
|
| MCULE-3053803449 |
0.70 |
N1(CCC[C@H]1C(O)=O)C(CCC1C=CC=CC=1)=O
|
|
| MCULE-7096381685 |
0.70 |
C(C1C=CC=CC=1)C(NC(=O)C([H])(N)CO)([H])C(=O)N.Cl
|
|
| MCULE-3048797583 |
0.70 |
CC(CC1C=CC(CCC(N(C(C(=O)O)C)CCNC(=O)C)=O)=CC=1)C
|
|
| MCULE-8679372991 |
0.70 |
C(CNC(CN)=O)(NC(CC1C=CC=CC=1)C(O)=O)=O
|
|
| MCULE-3016359840 |
0.70 |
CC(C1C=CC=CC=1)(CC(N1[C@@H](C(=O)O)CCC1)=O)C
|
|
| MCULE-9358059456 |
0.70 |
CC(C1C=CC=CC=1)(CC(N1C(C(=O)O)(C)CCC1)=O)C
|
|
| MCULE-7272251026 |
0.70 |
OC(C(NC(C1CCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-8142358231 |
0.70 |
CC(C(NC(C(O)=O)CC1=CC=CC=C1)=O)C1CC1
|
|
| MCULE-5906099198 |
0.70 |
CC1(C(NC(C(=O)O)CC2C=CC=CC=2)=O)CCC1
|
|
| MCULE-1957906331 |
0.70 |
N1(CC(C[C@H]1C(O)=O)O)C(=O)C1CCN(CC1)C(=O)[C@H](CC1=CC=CC=C1)NC(=O)OC(C)(C)C
|
|
| MCULE-6182222519 |
0.70 |
CC1(C(=O)O)N(C(CCC2C=CC=CC=2)=O)CCC1
|
|
| MCULE-4295162585 |
0.70 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@H]2CCO[C@@H]([C@H]2O)CN(C(=O)C2CC2)CC(=O)N[C@H](CC(C)C)C1=O
|
|
| MCULE-8942621595 |
0.70 |
CC(NCC(NCC(NC(C(=O)O)CC1C=CC=CC=1)=O)=O)=O
|
|
| MCULE-2644013450 |
0.70 |
N12C[C@@H](CC1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)=O)NC(COC(C)C)=O
|
|
| MCULE-6774556628 |
0.70 |
N1(CC(=O)NCC(NCCCC)=O)CC(CC1=O)C1C=CC=CC=1
|
|
| MCULE-5570963258 |
0.70 |
CN1C(=O)CN(C(CCC2=CC=C(O)C=C2)=O)C(C(O)=O)C1
|
|
| MCULE-6024102363 |
0.70 |
CC1(C(C)(C)C1C(NC(C(=O)O)CC1C=CC=CC=1)=O)C
|
|
| MCULE-2785575060 |
0.70 |
OC[C@H]1NC(=O)CN(C(C2(CC2)CC2=CC(Cl)=CC=C2)=O)C1
|
|
| MCULE-2196499832 |
0.70 |
CCCC(C(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)C(C)C
|
|
| MCULE-2026838180 |
0.70 |
CCC(NC(C(N1C(C(C2=CC=CC=C2)O)CCCC1)=O)C)=O
|
|
| MCULE-6637348429 |
0.70 |
OC([C@H](NC(C1CCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-8022512588 |
0.70 |
N1(C)C[C@H](C[C@H]1C(O)=O)NC(=O)CN1CCC(CC1)C1C=CC=CC=1
|
|
| MCULE-5385828876 |
0.70 |
CC(C(=O)O)N(C(CCC1C=CC(C)=CC=1)=O)CCNC(=O)C
|
|
| MCULE-2308280914 |
0.70 |
OC(C1=CC=CC=C1)C1N(C(CN2CC(=O)NCC2)=O)CCC1
|
|
| MCULE-2418151107 |
0.70 |
CC(CN(C(CNC(CCC1C=CC(C)=CC=1)=O)=O)CC(=O)O)C
|
|
| MolPort-028-295-445 |
0.70 |
CC(C)C(NC1CCOCC1)C(=O)N1CC(CC1C)C1=CC=CC=C1
|
|
| MolPort-045-916-138 |
0.70 |
CC(C)C[C@@H]1NC(=O)[C@@H]2CCC[C@H]2NC(=O)[C@H](C)NC(=O)C2C[C@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CC1=CC=C(Cl)C=C1
|
|
| MolPort-046-606-743 |
0.70 |
COCCN1CCN2[C@@H](CN([C@@H](CC3=CC=CC=C3)C2=O)C(=O)CC2CCCCC2)C1=O
|
|
| MolPort-046-740-103 |
0.70 |
O=C(CC1CCN(CC2=CC=CC=C2)CC1)N1C[C@H](CC2=CC=CC=C2)NC(=O)C1
|
|
| MolPort-007-892-365 |
0.70 |
COCCNC(=O)C1(C)CCC(=O)N1CCC1=CC=C(C)C=C1
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|
| MolPort-046-567-675 |
0.70 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)CC1=C(F)C=CC=C1Cl
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|
| MolPort-044-496-151 |
0.70 |
CC(=O)N1C[C@H](O)C[C@@H]1C(=O)NC1(CCCC1)C1=CC=C(C=C1)C(C)(C)C
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| MolPort-001-748-411 |
0.70 |
CN[C@@H](C(C)C)C(=O)N[C@H]1C[C@](O)(C[C@@H](O)[C@@H]1O)C(=O)N[C@@H](CC1=CC=C(OC)C=C1)C(N)=O
|
|
| MolPort-020-223-766 |
0.70 |
CCC(O)CNC(=O)C1(CC2=CC=CC=C2C1)N(C)CCC1=CC=CC=C1
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|
| MolPort-044-367-830 |
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NC(=O)[C@@H]1C[C@@H](O)CN1C1CCN(CC1)C(=O)CCCC1=CC=CC=C1
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|
| MolPort-020-193-493 |
0.70 |
CCC(CO)NC(=O)C1(CC2=CC=CC=C2C1)N(C)CCC1=CC=CC=C1
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|
| MolPort-046-168-429 |
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COCCN1CCN2[C@@H](CN([C@@H](CC3=CC=CC=C3)C2=O)C(=O)CC2CCCC2)C1=O
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|
| MolPort-020-187-775 |
0.70 |
CC(C)C(CO)NC(=O)C1(CC2=CC=CC=C2C1)N(C)CCC1=CC=CC=C1
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|
| MolPort-038-412-904 |
0.70 |
CC1=CC=C(CCC(=O)N2C[C@H](O)[C@H](C2)N2CCCCC2)C=C1C
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|
| MolPort-045-916-228 |
0.70 |
CC(C)C[C@@H]1NC(=O)CN(CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](C)N(C)C1=O)C(=O)CC1=CC=C(F)C=C1
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|
| MolPort-028-741-691 |
0.70 |
O=C(CN1CC(CC1=O)C1=CC=CC=C1)N1CCOC2(CCCC2)C1
|
|
| MolPort-045-932-909 |
0.70 |
CC(C)[C@H]1NC(=O)CN(CCNC(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](C)NC1=O)C(=O)CC1=C(F)C=CC(F)=C1
|
|
| MolPort-039-169-559 |
0.70 |
CO[C@H]1C[C@H](N(C)C1)C(=O)NCC1(CC1)C1=CC=CC=C1Cl
|
|
| MolPort-044-639-102 |
0.70 |
CO[C@H]1C[C@H]2CN(CC(=O)N2C1)C(=O)NCCC1=CC=CC=C1
|
|
| MolPort-027-888-605 |
0.70 |
OCCN1C[C@H](NC(=O)CCN2CCCCC2=O)[C@H](C1)C1=CC=CC=C1
|
|
| MolPort-046-196-827 |
0.70 |
CCCCCC(=O)N[C@@H](CC1=CC=C(O)C=C1)C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCCCCCC(N)=O
|
|
| MolPort-044-497-524 |
0.70 |
CC(=O)N1C[C@H](O)C[C@@H]1C(=O)NC1(CCCC1)C1=CC=CC(C)=C1
|
|
| MolPort-046-041-649 |
0.70 |
COCCN1CCN2[C@@H](CN([C@@H](CC3=CC=CC=C3)C2=O)C(=O)CCC2CCCC2)C1=O
|
|
| MolPort-009-086-481 |
0.70 |
CC(C)C(=O)N1CCCC1C(=O)NCCC1=CC=CC=C1
|
|
| MolPort-020-053-263 |
0.70 |
CC(CNC(=O)C(C)N1CC[C@@H](O)C1)C1=CC=CC=C1
|
|
| MolPort-009-122-506 |
0.70 |
CC(CNC(=O)C1CCCN1C(C)=O)C1=CC=CC=C1
|
|
| MolPort-027-884-735 |
0.70 |
CC1(C)CN(CC(=O)NCCC2=CC=CC=C2)C[C@]1(C)O
|
|
| MolPort-009-634-927 |
0.70 |
CC(=O)N1CCCC1C(=O)NCC(C)(C)C1=CC=CC=C1
|
|
| MolPort-020-135-555 |
0.70 |
CCCC(=O)N1CCCC1C(=O)NCCC(C)C1=CC=CC=C1
|
|
| MolPort-009-122-478 |
0.70 |
CC(=O)N1CCCC1C(=O)NCCC1=CC=CC=C1
|
|
| MolPort-003-850-600 |
0.70 |
[2H]C1=C([2H])C([2H])=C(CC[C@H](N[C@@H](C)C(=O)N2[C@H]3CCCC[C@@H]3C[C@H]2C(O)=O)C(O)=O)C([2H])=C1[2H]
|
|
| MolPort-005-943-923 |
0.70 |
C[C@H](N[C@@H](CCC1=CC=CC=C1)C(O)=O)C(=O)N1[C@H]2CCC[C@H]2C[C@H]1C(O)=O
|
|
| MolPort-023-152-764 |
0.70 |
CC(C)(C)OC(=O)N1CC(O)CC1C(=O)NCCCC1=CC=CC=C1
|
|
| MolPort-002-658-383 |
0.70 |
CC(C)[C@@H](NC(=O)[C@@H]1CCCN1C(=O)C1(CCN(CC1)C(=O)OC(C)(C)C)C1=CC=CC=C1)C(O)=O
|
|
| MolPort-003-850-598 |
0.70 |
O.C[C@H](N[C@@H](CCC1=CC=CC=C1)C(O)=O)C(=O)N1[C@H]2CCCC[C@@H]2C[C@H]1C(O)=O
|
|
| MolPort-046-793-237 |
0.70 |
C[C@H](N[C@@H](CCC1=CC=CC=C1)C(O)=O)C(=O)N1[C@@H]2CCC[C@@H]2C[C@H]1C(O)=O
|
|
| MolPort-046-690-883 |
0.70 |
[2H]C1=C([2H])C([2H])=C(CC[C@H](N[C@@H](C)C(=O)N2[C@@H]3CCC[C@@H]3C[C@H]2C(O)=O)C(O)=O)C([2H])=C1[2H]
|
|
| MolPort-046-568-074 |
0.70 |
CC(C)[C@H]1NC(=O)[C@H](CCCNC(=O)CN(C)C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C)NC1=O)NC(=O)COCC1=CC=CC=C1
|
|
| MolPort-046-477-018 |
0.70 |
NC(=O)[C@@H]1C[C@@H](O)CN1C(=O)[C@@H]1C[C@H]1C1=CC=C(OC(F)F)C=C1
|
|
| MolPort-020-162-753 |
0.70 |
CC(C)CC(=O)NC(C(C)C)C(=O)NCC(O)CC1=CC=CC=C1
|
|
| MolPort-035-515-629 |
0.70 |
CCC1=CC=C(CCC(=O)N2CCCC2C(=O)NC2CC2)C=C1
|
|
| MolPort-003-739-757 |
0.70 |
OC(=O)C1CCCN1C(=O)CCC1=CC=CC=C1
|
|
| MolPort-044-481-321 |
0.70 |
OC(=O)C(=O)NCC1CCCN1CCC1=CC=CC=C1
|
|
| MolPort-020-136-684 |
0.70 |
CC(CC1=CC2=CC=CC=C2C=C1)NC(=O)C1CCC(=O)N1
|
|
| MolPort-004-964-892 |
0.70 |
NCC(=O)NCC(=O)N[C@@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-035-373-825 |
0.70 |
O=C1NCCN(CC2CCCC2)[C@H]1CC1=CC=CC=C1
|
|
| MolPort-030-145-183 |
0.70 |
CC1CC1C(=O)N[C@H](CC1=CC=CC=C1)C(O)=O
|
|
| MolPort-002-321-891 |
0.70 |
CCCCNC(=O)CNC(=O)CN1CC(CC1=O)C1=CC=CC=C1
|
|
| MolPort-023-276-185 |
0.70 |
CSCC[C@H](NC(=O)[C@H](CC(C)C)N1CCC(NC(=O)[C@@H](NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](CO)NC(=O)[C@H](CC(O)=O)NC(=O)[C@@H](N)CCCCN)C(C)C)C1=O)C(N)=O
|
|
| MolPort-020-222-612 |
0.70 |
CN(CCC1=CC=CC=C1)C1(CC2=CC=CC=C2C1)C(=O)N[C@@H]1CNC[C@H]1O
|
|
| MolPort-041-933-027 |
0.70 |
CN(CC(=O)N1C[C@H]([C@@H](C1)C1=CC=C(Cl)C=C1)C(O)=O)C(C)=O
|
|
| MolPort-039-066-130 |
0.70 |
Cl.CO[C@@H]1CN[C@H](C1)C(=O)NCCCC1=CC=CC(F)=C1
|
|
| MolPort-044-517-490 |
0.70 |
CCC1=CC=C(CN(C2CC2)C(=O)[C@H]2C[C@@H](O)CN2C(C)=O)C=C1
|
|
| MolPort-044-483-437 |
0.70 |
OC1CCCCN(CC(=O)NCC2(CC2)C2=CC=CC(F)=C2)C1=O
|
|
| MolPort-039-167-103 |
0.70 |
CO[C@H]1C[C@H](N(C1)C(=O)CC1CC(C1)C1=CC=CC=C1)C(N)=O
|
|
| MolPort-046-429-765 |
0.70 |
OC(=O)[C@@H]1CC[C@@H](N1)C(=O)NCC1(CC1)C1=CC=CC(=C1)C(F)(F)F
|
|
| MolPort-039-174-083 |
0.70 |
CO[C@H]1C[C@@H](CN2CCCC2)N(C1)C(=O)CCC1=CC=C(C=C1)C#N
|
|
| MolPort-038-968-799 |
0.70 |
Cl.CO[C@@H]1CN[C@H](C1)C(=O)NCC1(CC2=CC=CC=C2)CCCC1
|
|
| MolPort-027-827-986 |
0.70 |
CC(=O)NC(C)(C)C(=O)N1C[C@H]([C@@H](C1)C1=C(C)C=CC=C1)C(O)=O
|
|
| MolPort-045-958-274 |
0.70 |
CN(C)[C@@H]1C[C@@H]2N(C1)C(=O)[C@H](CC1=CC=C(O)C=C1)NC2=O
|
|
| MolPort-028-574-978 |
0.70 |
CC1=C(F)C=CC(=C1)[C@@H]1C[C@@H]2CC[C@H](C1)N2C(=O)[C@@H]1C[C@@H](O)CN1
|
|
| MolPort-002-200-121 |
0.70 |
CC(C)C(NC(=O)C(CC1=CC=CC=C1)NC(=O)C1=CC=CC=C1)C(O)=O
|
|
| MolPort-044-674-976 |
0.70 |
CN(C)[C@@H]1C[C@@H]2N(C1)C(=O)[C@@H](CC1=CC=C(O)C=C1)NC2=O
|
|
| MolPort-027-895-217 |
0.70 |
O=C(CCC1CCCCO1)NC(CC1=CC=CC=C1)C(=O)NC1CC1
|
|
| MolPort-045-916-770 |
0.70 |
CC[C@H](C)[C@@H]1NC(=O)CN(CC2=CC=C(C)S2)CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O
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|
| MolPort-023-276-064 |
0.70 |
C[C@@H](O)[C@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CNC(=O)CNC(=O)CNCC1=CC=CC=C1)C(=O)NCC(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(=O)N[C@@H](CO)C(=O)N[C@@H](C)C(=O)N[C@@H](CCCNC(N)=N)C(=O)N[C@@H](CCCCN)C(N)=O
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|
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0.70 |
CC(CO)(CNC(=O)CNC(=O)CC1CCCC1)CC1=CC=CC=C1
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0.70 |
CC(CO)(CNC(=O)CNC(=O)CC1CCCCC1)CC1=CC=CC=C1
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0.70 |
FC1CCN(CC1)C(=O)CN1CC(CC1=O)C1=CC=CC=C1
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0.70 |
O=C(CN1CC(CC1=O)C1=CC=CC=C1)NC12CC3CC(CC(C3)C1)C2
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0.70 |
O=C(CN1CC(CC1=O)C1=CC=CC=C1)NC1C2CC3CC(C2)CC1C3
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|
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FC1=CC=C(CCC(=O)N2C[C@H](CC3=CC=CC=C3)NC(=O)C2)C=C1
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|
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| MolPort-046-570-474 |
0.69 |
CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)COC1=CC=C(Cl)C=C1
|
|
| MolPort-001-753-605 |
0.69 |
COCC(=O)N[C@H]1CCN([C@@H](C1)C(=O)N[C@H](CC1=CC=CC=C1)C(N)=O)C(=O)COC
|
|
| MolPort-027-862-593 |
0.69 |
COCCN(C)CC(=O)N1C[C@H]([C@@H](C1)C1=CC(F)=CC=C1)C(O)=O
|
|
| MolPort-023-276-173 |
0.69 |
CSCC[C@H](NC(=O)[C@H](CC(C)C)NC(=O)CCNC(=O)[C@@H](NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CO)NC(=O)[C@@H](N)CC(O)=O)C(C)C)C(N)=O
|
|
| MolPort-039-235-366 |
0.69 |
Cl.CO[C@@H]1CN[C@H](C1)C(=O)NCC(N1CCC(C)CC1)C1=CC=CC=C1
|
|
| MCULE-9000727658 |
0.69 |
OC(C(NC(C1CCC(NC(C2CCCC2)=O)CC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-2891597835 |
0.69 |
OC(C1C=CC(Cl)=CC=1Cl)CNC(C1NCC(O)C1)=O
|
|
| MCULE-8750865974 |
0.69 |
CC(C(NC(CC1=C(C)C=CC=C1)CO)=O)N1C(C)CCC1C
|
|
| MCULE-5318219994 |
0.69 |
C[C@@H](C(=O)O)NC(CNC(CCC1C=CC(C)=CC=1)=O)=O
|
|
| MCULE-4509284704 |
0.69 |
Cl.OC1CC(C(NCC2(C3C=CC=C(Br)C=3)CCOCC2)=O)NC1
|
|
| MCULE-9688674886 |
0.69 |
C[C@H](C(=O)O)NC(CNC(CCC1C=CC(C)=CC=1)=O)=O
|
|
| MCULE-4396993806 |
0.69 |
C(NCC(NCC(N[C@@H](CC1=CC=CC=C1)C(N[C@H](CC(C)C)C(O)=O)=O)=O)=O)([C@H](CC1C=CC(OC(=O)C)=CC=1)N)=O
|
|
| MCULE-2870931141 |
0.69 |
CC[C@@H]([C@@H](C(=O)O)NCC(NCCCC1C=CC=CC=1)=O)C
|
|
| MCULE-9145960888 |
0.69 |
CO[C@H]1C[C@H](C(NCC2(C3=C(C)C=CC=C3)CCOCC2)=O)NC1
|
|
| MCULE-4325249615 |
0.69 |
N1(CCN(C(=O)C1CCCC)C)C(CCC1=CC=CC=C1)=O
|
|
| MCULE-4020260685 |
0.69 |
CCOC(C(NC([C@@H]1NC(=O)CCC1)=O)CC1=CC=C(C)C=C1)=O
|
|
| MCULE-7085857612 |
0.69 |
CC(C(=O)O)N(C(CNC(CCC1C=CC(C)=CC=1)=O)=O)C
|
|
| MCULE-5631426479 |
0.69 |
N12CCC[C@@H]1C(=O)NCCOC1C=CC(C[C@H](N)C(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C2=O)=CC=1
|
|
| MCULE-5347225350 |
0.69 |
CCCC(C(O)=O)NC(C(NCC(C1=CC=CC=C1)C)=O)C
|
|
| MCULE-8181491818 |
0.69 |
CO[C@@H]1CN(C)[C@H](C(NCC2(C3=C(F)C=C(F)C=C3)CC2)=O)C1
|
|
| MCULE-9023868402 |
0.69 |
CC(C1CN(C(C(NC(CCC2=CC=CC=C2)C)=O)=O)CC1)O
|
|
| MCULE-1109044909 |
0.69 |
CCCC(N1C(C(NCC(C2C=CC=CC=2)C(=O)O)=O)CCC1)=O
|
|
| MCULE-5047504588 |
0.69 |
CC1C=C(C)C=C(CCC(N[C@@H](C(=O)O)CC2C=CC=CC=2)=O)C=1
|
|
| MCULE-4640497844 |
0.69 |
C1(N(C)CCC2C=CC=CC=2)(CC2C(=CC=CC=2)C1)C(=O)N1CCC(CC1)O
|
|
| MCULE-1050791926 |
0.69 |
CC1C=C(C)C=C(CCC(NC(C(=O)O)CC2C=CC=CC=2)=O)C=1
|
|
| MCULE-1388837211 |
0.69 |
C(N([C@@H]([C@@H](C)CC)[C@H](OC)CC(N1CCC[C@H]1[C@H](OC)[C@@H](C)C(N[C@H](C)[C@@H](O)C1=CC=CC=C1)=O)=O)C)(=O)[C@@H](NC(=O)[C@@H](NC)C(C)C)C(C)C
|
|
| MCULE-4559668225 |
0.69 |
C1(CC2C(=CC=CC=2)C1)(C(=O)N1CCC(CC1)CO)N1C[C@H](C)O[C@H](C)C1
|
|
| MCULE-8587792542 |
0.69 |
O=C(NC(CC1C=CC=CC=1)CN1CCOCC1)CCC1CNCC1
|
|
| MCULE-3319841426 |
0.69 |
N1(CC(=O)NC(C)C(NC)=O)CC(CC1=O)C1=CC=CC=C1
|
|
| MCULE-8847896683 |
0.69 |
C(=O)(OC(C)(C)C)N1CCC(CC1)(C1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-7949722381 |
0.69 |
C[C@H]1[C@@H](NC(C(NC(N)=O)CC2=CC=CC=C2)=O)CCO1
|
|
| MCULE-9051758257 |
0.69 |
OC(C(CC1C=CC2C=CC=CC=2C=1)CNC(CN1C(=O)CCCCCC1)=O)=O
|
|
| MCULE-1778156408 |
0.69 |
COCC1(NCCC1)CNC(C1C2C=CC=CC=2C1)=O
|
|
| MCULE-9293934226 |
0.69 |
CC(CC(N1C(C(NCC(C2=CC=CC=C2)(C(O)=O)C)=O)CCC1)=O)(C)C
|
|
| MCULE-6494784472 |
0.69 |
CC(C(=O)O)NC(CNC(CCC1C=CC(C)=CC=1)=O)=O
|
|
| MCULE-3264200941 |
0.69 |
O(C)[C@H]([C@H](C(N[C@H](C)[C@H](C1=CC=CC=C1)O)=O)C)[C@@H]1CCCN1C(C[C@H]([C@@H]([C@@H](C)CC)N(C)C([C@H](C(C)C)NC([C@H](C(C)C)NC)=O)=O)OC)=O
|
|
| MCULE-8116270546 |
0.69 |
C(C(=O)N1CCC(C(NC(=O)CC(C)C)C(N(CC)CC)=O)CC1)CC1C=CC=CC=1
|
|
| MCULE-3214641725 |
0.69 |
CCCC(N1C(C(NCC(C2=CC=CC=C2)(C(O)=O)C)=O)CCC1)=O
|
|
| MCULE-1469954768 |
0.69 |
CN(C(CCC1C=CC=C(C)C=1)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-1896749054 |
0.69 |
C(=O)(C1(C2C=CC=CC=2)CCN(CC1)C(=O)OC(C)(C)C)N1CCC[C@H]1C(=O)N[C@@H](CC(C)C)C(O)=O
|
|
| MCULE-3191048788 |
0.69 |
O=C(NC(CC1=CC=CC=C1)CN1CCCCC1)CNC(C1CC1)=O
|
|
| MCULE-7771653858 |
0.69 |
N(C)(C)[C@@H](C(C)C)C(=O)N[C@@H](C(C)C)C(=O)N(C)[C@@H]([C@@H](C)CC)[C@H](OC)CC(=O)N1CCC[C@H]1[C@H](OC)[C@H](C(=O)N[C@H](C)[C@@H](O)C1=CC=CC=C1)C
|
|
| MCULE-3787019432 |
0.69 |
CCCC(C(=O)O)NCC(NCCCC1C=CC=CC=1)=O
|
|
| MCULE-2025419458 |
0.69 |
N1(C[C@@H]2C[C@@H](CN2C(=O)[C@@H]1CC1C=CC=CC=1)OC)C(=O)NC1C=CC=CC=1
|
|
| MCULE-1641698556 |
0.69 |
C(C(=O)N1CCC(C(NC(=O)CC(C)C)C(N2CCCCC2)=O)CC1)CC1C=CC=CC=1
|
|
| MCULE-6636065621 |
0.69 |
CN(C([C@]1(C2=CC=CC=C2)C[C@H](O)C1)=O)C1C(=O)N(C)CCCC1
|
|
| MCULE-7407700939 |
0.69 |
CCOC1=CC=C(C2(CCOCC2)CNC([C@@H]2NC[C@@H](O)C2)=O)C=C1
|
|
| MCULE-3146513130 |
0.69 |
CC(C(NCC(C(=O)O)CC1C=CC2C=CC=CC=2C=1)=O)NC(C1CCCC1)=O
|
|
| MCULE-4339748981 |
0.69 |
CN1C(C(NCC2(C3=C(Cl)C=CC=C3)CCOCC2)=O)(C)CC(O)C1
|
|
| MCULE-1715254841 |
0.69 |
CO[C@@H]1CN(CC(NCC2(C3=CC=CC=C3)CC2)=O)[C@H](CO)C1
|
|
| MCULE-3432643507 |
0.69 |
N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1C=CC(=CC=1)OC)C(=O)COC(C)C
|
|
| MCULE-8672107310 |
0.69 |
CC(C(NCC(C(=O)O)CC1C=CC=C(C)C=1)=O)NC(C1CCCC1)=O
|
|
| MCULE-1318127796 |
0.69 |
OC([C@H]1[C@@H](C2C=CC=CC=2)CN(C(CNC(NC2CCCCC2)=O)=O)C1)=O
|
|
| MCULE-7513883360 |
0.69 |
C1(C2=CC=CC=C2C)(CC(=O)N2CCN(C(=O)C2)C2CCCC2)CC(N(CCOC)C1=O)=O
|
|
| MCULE-3010760343 |
0.69 |
N1C2(CCOCC2)C(=O)N[C@@H](CC2=CC=C(C=C2)OC)C1=O
|
|
| MCULE-3363656477 |
0.69 |
CCCC(N1C(C(NCC(C(=O)O)CC2C=CC=C(C)C=2)=O)CCCC1)=O
|
|
| MCULE-5606835394 |
0.69 |
C1(CC2C=CC(O)=CC=2)C(=O)NC(C)C(=O)N1
|
|
| MCULE-1897007200 |
0.69 |
OC(C(CC1C=CC=C2C=1C=CC=C2)CNC(CN1C(=O)CCCCC1)=O)=O
|
|
| MCULE-7431375016 |
0.69 |
C1(CC2C=CC(O)=CC=2)C(=O)NC(C(C)C)C(=O)N1
|
|
| MCULE-8015895956 |
0.69 |
C(=O)(C1(C2C=CC=CC=2)CCN(CC1)C(=O)OC(C)(C)C)N1CCC[C@H]1C(=O)N[C@H](CC(C)C)C(O)=O
|
|
| MCULE-5388775947 |
0.69 |
CC(C[C@@H](C(=O)O)NC(CNC(CCCC1C=CC=CC=1)=O)=O)C
|
|
| MCULE-5849206979 |
0.69 |
CN1[C@H](C(NC(CC2=CC=C(F)C=C2)CO)=O)CCCC1
|
|
| MCULE-7798615047 |
0.69 |
N1(CCNC(=O)C1CC1C=CC=CC=1)CC(=O)NC1CCCCCC1
|
|
| MCULE-9001694123 |
0.69 |
CC1CN(C(C2N(C(CC3C=CC=CC=3)=O)CCC2)=O)CC(C(=O)O)C1
|
|
| MCULE-4551978007 |
0.69 |
C1(CC2C=CC(O)=CC=2)C(=O)NC(CC2C=CC=CC=2)C(=O)N1
|
|
| MCULE-6886992902 |
0.69 |
CCC(C1C=CC=CC=1)(C(=O)O)CNC(CNC(CCC(C)C)=O)=O
|
|
| MCULE-9094573618 |
0.69 |
CC(C[C@@H](C(=O)O)NC(CNC(CC1C=CC=C2C=1C=CC=C2)=O)=O)C
|
|
| MCULE-1366006259 |
0.69 |
O=C(N1C(C(NC2CCOCC2)=O)CCC1)CC1=CC=CC=C1
|
|
| MCULE-4023054509 |
0.69 |
CC1=C(C2(CC2)CNC(C2N(C(C3CC3)=O)CCC2)=O)C=CC=C1
|
|
| MCULE-4442787414 |
0.69 |
OC(C(CC1C=CC2C=CC=CC=2C=1)CNC(CN1C(=O)CCCCC1)=O)=O
|
|
| MCULE-8817593088 |
0.69 |
N1[C@@H](C(C)C)C(=O)N[C@H](CC2C=CC(=CC=2)O)C1=O
|
|
| MCULE-1420941438 |
0.69 |
CCCC(C(NC(C(=O)O)CC(F)F)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-3308180881 |
0.69 |
CC(C(NCC(C(=O)O)CC1C=CC=CC=1)=O)NC(C(C)(C)C)=O
|
|
| MCULE-5824188341 |
0.69 |
OC(C(CC1C=CC=C2C=1C=CC=C2)CNC(CN1C(=O)CCCCCC1)=O)=O
|
|
| MCULE-4091488125 |
0.69 |
CC(C[C@@H](C(=O)O)NC(CNC(CCC(C1C=CC=CC=1)C)=O)=O)C
|
|
| MCULE-8059717389 |
0.69 |
COCC(N[C@H](C(N1C[C@@H](C2C=CC=CC=2)[C@H](N)C1)=O)C(C)C)=O
|
|
| MCULE-3946236909 |
0.69 |
N1(CC[C@H]([C@H](O)C1)C1=CC=C2C(C=CC=C2)=C1)C(=O)CN1CCNCC1
|
|
| MCULE-2981181391 |
0.69 |
CO[C@H]1CN(CC(NCC2(C3=CC=CC=C3)CC2)=O)[C@H](CO)C1
|
|
| MCULE-2754187492 |
0.69 |
CC(C(C(N(CC(N1CCC(C(=O)O)CC1)=O)C)=O)CC1C=CC=CC=1)C
|
|
| MCULE-5241239319 |
0.69 |
COCC1(NCCC1)CNC(CCC1C=CC(C)=CC=1)=O
|
|
| MCULE-2305007242 |
0.69 |
CC(C1C=CC(C(CC(N(CC(N2CCC(C(=O)O)CC2)=O)C)=O)C)=CC=1)C
|
|
| MCULE-6467118611 |
0.69 |
C(=O)(C1(C2C=CC=CC=2)CCN(CC1)C(=O)OC(C)(C)C)N1CCCC1C(=O)NC(CC(C)C)C(O)=O
|
|
| MCULE-7075684715 |
0.69 |
CC(C[C@H](C(=O)O)NC(CNC(CC1C=CC=C2C=1C=CC=C2)=O)=O)C
|
|
| MCULE-7306481388 |
0.69 |
N1(CC2CC(CN2C(=O)C1CC1C=CC=CC=1)OC)C(=O)NC1C=CC=CC=1
|
|
| MCULE-1171229606 |
0.69 |
CN(C(CCC1C=CC(C)=CC=1)=O)CC(N1CCC(C(=O)O)CC1)=O
|
|
| MCULE-6398735075 |
0.69 |
C(F)(F)(F)C(=O)O.C(N1CCC[C@H]1C(N[C@@H](CCCCN)C(N1CCC[C@H]1C(N[C@@H](CCC(N)=O)C(N[C@@H](CCC(N)=O)C(N[C@@H](CC1=CC=CC=C1)C(O)=O)=O)=O)=O)=O)=O)([C@H](CCCNC(N)=N)N)=O
|
|
| MCULE-4358547831 |
0.69 |
CCC1C=CC(C(CC(N(CC(N2CCC(C(=O)O)CC2)=O)C)=O)C)=CC=1
|
|
| MCULE-7023897008 |
0.69 |
CC(CC(N1C(C(NCC(C2C=CC=CC=2)C(=O)O)=O)CCC1)=O)(C)C
|
|
| MCULE-3177031456 |
0.69 |
COCCNC(CNC(C(CC1C=CC=CC=1)N)=O)=O
|
|
| MCULE-2579581477 |
0.69 |
CN(C(CN1C(=O)C(O)CCCC1)=O)CCC1=C(C)C=CC=C1
|
|
| MCULE-3055491731 |
0.69 |
CC(C[C@@H](C(=O)O)NC(CNC(CCC(C1C=CC=CC=1)(C)C)=O)=O)C
|
|
| MCULE-9508384957 |
0.69 |
Cl.OC(C1N(CC(NCCCC2C=CC=CC=2)=O)C2C(CCCC2)C1)=O
|
|
| MCULE-9760468442 |
0.69 |
CC(CC(NC(C(NCC(C(=O)O)CC1C=CC=CC=1)=O)C(C)C)=O)C
|
|
| MCULE-8164852118 |
0.69 |
CCN1C(=O)C(=O)N(CC(N2C(CCC3=CC=CC=C3)C(O)CCC2)=O)CC1
|
|
| MCULE-5170502755 |
0.69 |
CC1C=CC(CCC(NCC(N2CCC(CC(=O)O)CC2)=O)=O)=CC=1
|
|
| MCULE-8986609135 |
0.69 |
CC1C=CC=C(CC(C(=O)O)CNC(CN2C(=O)CCCCCC2)=O)C=1
|
|
| MCULE-2101116608 |
0.69 |
CN(C(CCC1C=CC(C(C)(C)C)=CC=1)=O)CC(N1CCC(C(=O)O)CC1)=O
|
|
| MCULE-5251240254 |
0.69 |
CC1C=CC=C(CC(C(=O)O)CNC(CN2C(=O)CCCCC2)=O)C=1
|
|
| MCULE-5918596389 |
0.69 |
OC(C(C1CC1)NC(CNC(CC1C=CC=CC=1)=O)=O)=O
|
|
| MCULE-2953296076 |
0.69 |
N1(C[C@H](CC)NC(=O)[C@H](CC2C=CC=CC=2)NC([C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C1)=O)C(=O)CCN1CCCCC1=O
|
|
| MCULE-5452828722 |
0.69 |
CCC1C=CC(CCC(N(CC(N2CCC(C(=O)O)CC2)=O)C)=O)=CC=1
|
|
| MCULE-4113806719 |
0.69 |
C(C)(C)[C@H](NC)C(N[C@H](C(N([C@@H]([C@@H](C)CC)[C@@H](CC(=O)N1[C@]([H])([C@H](OC)[C@@H](C)C(=O)N[C@H](C)[C@H](C2C=CC=CC=2)O)CCC1)OC)C)=O)C(C)C)=O
|
|
| MCULE-8109486049 |
0.69 |
CC[C@@H]([C@@H](C(=O)O)NC(C(N1CCC(CC2C=CC=CC=2)CC1)C)=O)C
|
|
| MCULE-2312049746 |
0.69 |
C(C)(C)[C@H](N(C)C)C(N[C@H](C(N([C@@H]([C@@H](C)CC)[C@@H](CC(=O)N1[C@]([H])([C@H](OC)[C@@H](C)C(=O)N[C@H](C)[C@H](C2C=CC=CC=2)O)CCC1)OC)C)=O)C(C)C)=O
|
|
| MCULE-9570402682 |
0.69 |
N1C(CC2=CC=C(O)C=C2)C(=O)NC(CC2=CC=C(O)C=C2)C1=O
|
|
| MCULE-9353193273 |
0.69 |
OC(C1CN(C(C2N(C(CC3C=CC=CC=3)=O)CCC2)=O)CCC1)=O
|
|
| MCULE-3516286385 |
0.69 |
CC(CC1C=CC(CCC(N(CC(N2CCC(C(=O)O)CC2)=O)C)=O)=CC=1)C
|
|
| MCULE-4509543367 |
0.69 |
CC(C(NCC(C(=O)O)CC1C=CC=C2C=1C=CC=C2)=O)NC(C1CCCC1)=O
|
|
| MCULE-4519770169 |
0.69 |
CC(C1C=CC(CCC(N(CC(N2CCC(C(=O)O)CC2)=O)C)=O)=CC=1)C
|
|
| MCULE-6478058843 |
0.69 |
CC(C[C@@H](C(=O)O)NC(CNC(CCC1C=CC=C(Br)C=1)=O)=O)C
|
|
| MCULE-9438446766 |
0.69 |
CCCC(C(O)=O)NC(C(N1CCC(CC2=CC=CC=C2)CC1)C)=O
|
|
| MCULE-1962248542 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)NCCCC[C@H](NC(=O)C1CC1)C(N[C@H](C)C(=O)N[C@@H](CC1C3C=CC=CC=3NC=1)C(=O)N[C@H](CC(C)C)C2=O)=O)O
|
|
| MCULE-8828975736 |
0.69 |
N1(CCCCC1C(=O)NCC1(C2=CC=CC=C2)CCN(CC1)C)C(C)=O
|
|
| MCULE-9306548642 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)NCCCC[C@H](NC(C1CCC1)=O)C(N[C@H](C)C(=O)N[C@@H](CC1C3C=CC=CC=3NC=1)C(=O)N[C@H](CC(C)C)C2=O)=O)O
|
|
| MCULE-2880408992 |
0.69 |
CC1C=CC=CC=1C1CN(C(C2NCCC2)=O)CC1
|
|
| MCULE-9351922761 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(C1CCCC1)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-9566912266 |
0.69 |
CCCC(C(=O)O)NC(CNC(CC1C=CC=C2C=1C=CC=C2)=O)=O
|
|
| MCULE-4149890424 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(CC1CCCCC1)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-7558401856 |
0.69 |
N1(CC(C)C)CC(O)CN(C(CCC2=CC=CC=C2)=O)CC1=O
|
|
| MCULE-2292562627 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)CC1CCC1)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-2678995891 |
0.69 |
COCCNCC(N1C(C)CC(C2=CC=CC=C2)C1)=O
|
|
| MCULE-3484315974 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)C1=CC=CN1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-1322289713 |
0.69 |
C(=O)([C@H](CC1C=CC=CC=1)N(C)C)N1CCC(CC1)N1CCC(CC1)O
|
|
| MCULE-1942123413 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(CCCNC(C)=O)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-5803374488 |
0.69 |
CC(C[C@@H](C(=O)O)NC(CNC(CNC(CC1C=CC=CC=1)=O)=O)=O)C
|
|
| MCULE-9586717063 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(=O)C1=CC=CN=C1)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-6664703276 |
0.69 |
CC(C(N(CC(N1CCC(C(O)=O)CC1)=O)C)=O)CC1=CC=C(C)C=C1
|
|
| MCULE-3983229690 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(CCCN1CCCC1=O)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-2612058204 |
0.69 |
N1(CC(CC1=O)CC1C=CC=CC=1)CC(=O)N(C)CCC1=CC=CC=C1
|
|
| MCULE-5588629929 |
0.69 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@@H](C(C)C)C2=O)C(=O)N1CCN(CC1)C1CCCCC1
|
|
| MCULE-2758761836 |
0.69 |
CC[C@@H]([C@@H](C(=O)O)NC(CNC(CC1C=CC=C2C=1C=CC=C2)=O)=O)C
|
|
| MCULE-1535232465 |
0.69 |
O=C(N[C@@H](CC1C=CC=CC=1)[C@@H](C[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N)CC1C=CC=CC=1)CC(C)C)CC1C=CC=CC=1)O)OC(C)(C)C
|
|
| MCULE-3861687425 |
0.69 |
N12CCNC(=O)C1CC1(CCN(CC1)C(CCC1=CC=CC=C1)=O)C2
|
|
| MCULE-2460831977 |
0.69 |
O(C(C)(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)[C@H](O)C[C@@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N
|
|
| MCULE-1249612263 |
0.69 |
OC(C1(NC(CNC(CC2C=CC=CC=2)=O)=O)CCC1)=O
|
|
| MCULE-9152810372 |
0.69 |
C(=O)([C@H]1CC2C=CC(=CC=2)OCC(N[C@@H](CC(C)C)C(=O)N(CCOC)CC(=O)N1)=O)N1CCC[C@H]1CO
|
|
| MCULE-5948552195 |
0.69 |
CC1C=CC(CCC(NCC(N2CCC(C(=O)O)CC2)=O)=O)=CC=1
|
|
| MCULE-7151454041 |
0.69 |
C(=O)([C@@H]1CC2C=CC(=CC=2)OCC(N[C@@H](CC(C)C)C(=O)N(CCOC)CC(=O)N1)=O)N1CCC[C@H]1CO
|
|
| MCULE-1451327303 |
0.69 |
C(=O)(NCC1CCN(CC1)CC[C@H](O)C1=CC=CC=C1)[C@@H]1CCCN1C
|
|
| MCULE-1441973828 |
0.69 |
OC(C1(C2=CC=CC=C2)CN(C(CNC(C2CC2)=O)=O)CC1)=O
|
|
| MCULE-6022204365 |
0.69 |
O=C(C1N(C(C23CC4CC(C2)CC(C4)C3)=O)CCC1)NCC1(C2=CC=CC=C2)CC1
|
|
| MCULE-7977687315 |
0.69 |
CC(C1C=CC(F)=CC=1)CC(N(CC(N1CC(C(=O)O)CCC1)=O)C)=O
|
|
| MCULE-7629272231 |
0.69 |
N1(CCCCC1=O)CC(=O)NC1(CC2=CC=CC(C)=C2)CC1
|
|
| MCULE-5890546012 |
0.69 |
NC1(C(N2CC(C3=CC=CC=C3)(O)CCC2)=O)CC2=C(C=CC=C2)C1
|
|
| MCULE-5746381632 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)C1CCN(CC1)CC(N)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-6664386925 |
0.69 |
CN(C(CCC1C=CC(F)=CC=1)=O)CC(N1CC(C(=O)O)CCC1)=O
|
|
| MCULE-4238781580 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)CC1C=CC(=CC=1)C(C)C)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-7127911657 |
0.69 |
N1(C(CCCC2=CC=CC=C2)=O)C[C@@H](C[C@H]1C(O)=O)N(C)C
|
|
| MCULE-8485452386 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)NCCCC[C@H](NC(=O)[C@H]1CCC(=O)N1)C(N[C@H](C)C(=O)N[C@@H](CC1C3C=CC=CC=3NC=1)C(=O)N[C@H](CC(C)C)C2=O)=O)O
|
|
| MCULE-9445683887 |
0.69 |
CN(C(C1C2C=CC=CC=2C1)=O)CC(N1CCC(C(=O)O)CC1)=O
|
|
| MCULE-4590922848 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(C1CCCCCC1)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-2901357777 |
0.69 |
CN1C(=O)CCC1C(NCC1(CC2=C(C=CC=C2)C1)O)=O
|
|
| MCULE-5923658271 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)NCCCC[C@H](NC(=O)CN1CCCC1=O)C(N[C@H](C)C(=O)N[C@@H](CC1C3C=CC=CC=3NC=1)C(=O)N[C@H](CC(C)C)C2=O)=O)O
|
|
| MCULE-1212976129 |
0.69 |
CC1N(C(C2NCCOC2)=O)CCC1C1C=CC=CC=1
|
|
| MCULE-8098632400 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)CC1CCCCC1)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-4919721696 |
0.69 |
CN1C(=O)CN(C(CCC2=CC=C(Cl)C=C2)=O)C(C(O)=O)C1
|
|
| MCULE-4556778216 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)NCCCC[C@H](NC(=O)[C@@H]1CCC(=O)N1)C(N[C@H](C)C(=O)N[C@@H](CC1C3C=CC=CC=3NC=1)C(=O)N[C@H](CC(C)C)C2=O)=O)O
|
|
| MCULE-8035966489 |
0.69 |
N1(C[C@@H](C[C@H]1C(N)=O)O)C1CCN(CC1)C(=O)CC1=CC=CC=C1C
|
|
| MCULE-3900079493 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)CC1CCCC1)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-6710531097 |
0.69 |
OC(CNC(CN1CC(C2C=CC=CC=2)CC1)=O)=O
|
|
| MCULE-7181160112 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(CCC1CCC1)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-3092822878 |
0.69 |
CCN1CCN(C(C(NC(CN(C)C)=O)CC2=CC=CC=C2)=O)CC1
|
|
| MCULE-5312544260 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)CSC1C=CC=C(OC)C=1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-4658777269 |
0.69 |
CC([C@@H](C(NCC(N1CC(C2C=CC=CC=2)CC1)=O)=O)N)C
|
|
| MCULE-2700768460 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)CCC(=O)N(C)C)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-3849965186 |
0.69 |
CC(CC(N1C(C(N2CC(CC3=CC=CC=C3)C2)=O)CCC1)=O)(C)C
|
|
| MCULE-4890990173 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)[C@@H]1CC[C@H](CC1)CC)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-8546064604 |
0.69 |
C(C)(C(O)=O)NC(C(CC1=CC=CC=C1)N)=O
|
|
| MCULE-1918954674 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(CC(=O)N[C@@H]([C@@H](C)CC)C2=O)C(=O)C1C=CC=CC=1OCC=C)O
|
|
| MCULE-3511516984 |
0.69 |
CC(N1[C@H](C(N2CCC(C3=CC=CC=C3)CC2)=O)CCC1)=O
|
|
| MCULE-3745652397 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(C1CCNCC1)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-3925383193 |
0.69 |
C(CNC(CCC1C=CC=CC=1)=O)(=O)NCC(O)=O
|
|
| MCULE-4262426842 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(=O)C1=CC=C(C=C1)N1C=CN=C1)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-1812137553 |
0.69 |
N1(C)CCC[C@H]1C(NCCCC1=CC=CC(C)=C1)=O
|
|
| MCULE-8050176579 |
0.69 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(C1CCCCC1)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-9626480804 |
0.69 |
CC1(C2=CC=CC=C2)CN(CC(NCC(O)=O)=O)CC1
|
|
| MCULE-4290987214 |
0.69 |
N1(C[C@H](C[C@H]1C(N)=O)OC1=CC=CC=C1)C(CCC1=CC=CC=C1)=O
|
|
| MCULE-2543772794 |
0.69 |
O=C(C1NCCC1)NCC1(C2C=CC=CC=2)CC1
|
|
| MCULE-3787529216 |
0.69 |
N1(CCN(C(C)(C)C1)CC)C(=O)[C@H]1CC2=CC=C(C=C2)OCC(N[C@@H](CC(C)C)C(=O)N(CCOC)CC(=O)N1)=O
|
|
| MCULE-1337288206 |
0.69 |
CC1N(C(CNC(CN)=O)=O)CCC1C1=CC=CC=C1
|
|
| MCULE-3498943309 |
0.69 |
C1(=O)[C@H](CC(C)C)NC(COC2=CC=C(C=C2)C[C@@H](NC(=O)CN1CCOC)C(=O)N1CCCC1)=O
|
|
| MCULE-6243913901 |
0.69 |
CCCC(NCC(N(CC(O)=O)CCC1=CC=CC=C1)=O)=O
|
|
| MCULE-1730441692 |
0.69 |
C1(=O)[C@H](CC(C)C)NC(COC2=CC=C(C=C2)C[C@H](NC(=O)CN1CCOC)C(=O)N1CCCC1)=O
|
|
| MCULE-5786208006 |
0.69 |
CC(CC(NCC(N(CC(O)=O)CCC1=CC=CC=C1)=O)=O)(C)C
|
|
| MCULE-2139658927 |
0.69 |
N1(CC(CC1C(N)=O)OC1=CC=CC=C1)C(CCC1=CC=CC=C1)=O
|
|
| MCULE-3287971751 |
0.69 |
C[C@@H](C(=O)O)NC(=O)[C@H](CC1C=CC=CC=1)N
|
|
| MCULE-8272643404 |
0.69 |
CO[C@@H]1CN(C(CCC2=C(OC)C=CC=C2)=O)[C@H](C(N)=O)C1
|
|
| MCULE-7656458319 |
0.69 |
N12CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)OCC(=O)N[C@@H](CCC1C=CC=CC=1)C2=O)C(O)=O
|
|
| MCULE-3944528915 |
0.69 |
N1(CCN(C(C)(C)C1)CC)C(=O)[C@@H]1CC2=CC=C(C=C2)OCC(N[C@@H](CC(C)C)C(=O)N(CCOC)CC(=O)N1)=O
|
|
| MCULE-4136971417 |
0.69 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@H](CC1=CC=C(C=C1)OCC(=O)N[C@H](CC1C=CC=CC=1)C2=O)C(=O)NCC1(CCCCC1)O
|
|
| MCULE-5528156696 |
0.69 |
OC(C1(NC(CNC(CC2C=CC=CC=2)=O)=O)CCCC1)=O
|
|
| MCULE-4007294322 |
0.69 |
C(=O)(C(CC1=CC=CC=C1)NC(C1=CC=CC=C1)=O)NC(CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-6165911057 |
0.69 |
N1[C@@H](C(C)C)C(=O)N(C)CC(=O)N[C@@H](CC2=CC=CC=C2)C(NCCCN(C(CCCC(C)C)=O)[C@H](C)C1=O)=O
|
|
| MCULE-8649871202 |
0.69 |
[C@@H]1(C(O)=O)CN(C[C@H]1C1=CC=CC(F)=C1)C(=O)CNC(C)=O
|
|
| MCULE-8704285512 |
0.69 |
CC1=CC(CC(NC(C2N(C3CCCC3)CC2)=O)CO)=CC=C1
|
|
| MCULE-5925588778 |
0.69 |
CN(C1(CC2=C(C=CC=C2)C1)CNC(CN1C(=O)C(O)CCCC1)=O)C
|
|
| MCULE-7952608436 |
0.69 |
CCCC(C(NC(CC1C=CC=CC=1)CN1CCOCC1)=O)N
|
|
| MCULE-4341494223 |
0.69 |
CN1C(C(NCCCC2=C(F)C=C(Br)C=C2)=O)(C)CC(O)C1
|
|
| MCULE-5444113787 |
0.69 |
CC1C=CC=CC=1CCNC(CN1C(C(=O)O)CCC1)=O.Cl
|
|
| MCULE-4388000401 |
0.69 |
CC1(C2CC2)C(=O)N(CC(NC(C(=O)O)CC2C=CC=CC=2)=O)C(=O)N1
|
|
| MCULE-6532683846 |
0.69 |
N1(C[C@H](CC2C=CC=CC=2)NC(=O)C1)C(=O)C1CCN(CC1)C(C1CCCC1)=O
|
|
| MCULE-6209103608 |
0.69 |
CC(C(NC(C(O)=O)CC1=C2C(C=CC=C2)=CC=C1)=O)C1CC1
|
|
| MCULE-1595315158 |
0.69 |
CCCCC(C(O)=O)NC(CNC(CC1=C2C(C=CC=C2)=CC=C1)=O)=O
|
|
| MCULE-4130645549 |
0.69 |
OC([C@H]1N(C(CCC2C=CC3C=CC=CC=3C=2)=O)CCC1)=O
|
|
| MCULE-9792634510 |
0.69 |
Cl.COC1CN(C(C(CC2=CC=CC=C2)N)=O)CCC1
|
|
| MCULE-6664225346 |
0.69 |
CC1(C(=O)O)N(C(CCC2C=CC3C=CC=CC=3C=2)=O)CCC1
|
|
| MCULE-7252200108 |
0.69 |
CC1C=CC(CCC(NCC(N2CC(C(=O)O)CC2)=O)=O)=CC=1
|
|
| MCULE-3655387558 |
0.69 |
CCCC(C(NC(C(=O)O)CC1C=CC=CC=1)=O)CCC
|
|
| MCULE-9110467712 |
0.69 |
N1(CC[C@@]([C@@H](CC2C=CC=CC=2)C1)(C)O)C(=O)CN1CCCCCC1=O
|
|
| MCULE-4115887589 |
0.69 |
OC(C1N(C(CCC2C=CC3C=CC=CC=3C=2)=O)CCC1)=O
|
|
| MCULE-9753233960 |
0.69 |
COC[C@@H]1[C@H](NC(CNC(CCC2=CC=C(C)C=C2)=O)=O)CC1
|
|
| MCULE-5711732444 |
0.69 |
CC1C=CC=C(CCC(N2[C@H](C(=O)O)CCC2)=O)C=1
|
|
| MCULE-2969036889 |
0.69 |
CC1C=CC(CCC(NCC(N2CC(C(=O)O)(C)CC2)=O)=O)=CC=1
|
|
| MCULE-4339503762 |
0.69 |
N1(C[C@@H]2CCCN2C(=O)[C@@H]1C)C(=O)CC(C1=CC=CC=C1)C1=CC=CC=C1
|
|
| MCULE-2775203629 |
0.69 |
OC(C(NC(CNC(CC1C=CC=CC=1)=O)=O)CC1CC1)=O
|
|
| MCULE-9815803337 |
0.69 |
CC1C=C(C)C=C(CCC(N2C(C(=O)O)CCC2)=O)C=1
|
|
| MCULE-6198611783 |
0.69 |
C(=O)(N[C@H](CO)CC1C=CC=CC=1)C1CCCN(CC(N)=O)C1
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|
| MCULE-3128329705 |
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OC([C@@H]1N(C(CCC2C=CC3C=CC=CC=3C=2)=O)CCC1)=O
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|
| MCULE-1958736462 |
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O[C@@H]1C[C@](C2=CC=CC=C2)(C(N2CCN(CC(N3CCCCC3)=O)CC2)=O)C1
|
|
| MCULE-8291241019 |
0.69 |
CCC(C1C=CC=CC=1)C(N(C(C(=O)O)C)CCNC(=O)C)=O
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|
| MCULE-2389040742 |
0.69 |
CC1C=CC(CCC(NCC(NCC(C(=O)O)(O)C)=O)=O)=CC=1
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|
| MCULE-3269445899 |
0.69 |
NCCC(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)=O
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|
| MCULE-7668768645 |
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CCNC(CCCC(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)=O
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|
| MCULE-3170011724 |
0.69 |
O=C(NC(CC1=CC=CC=C1)CN1CCCCC1)CN1C(=O)CCC1
|
|
| MCULE-9248659529 |
0.69 |
CC(NC(CCCC(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)=O)C
|
|
| MCULE-6450785998 |
0.69 |
CCC1(C(NC(C(=O)O)CC2C=CC=CC=2)=O)CCC1
|
|
| MCULE-9914374914 |
0.69 |
OC1CN(C(CC2=CC3=C(C=CC=C3)C=C2)=O)C(C(O)=O)C1
|
|
| MCULE-4441710671 |
0.69 |
CC(C(C(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)=O)C)N
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|
| MCULE-1801575727 |
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C1(O)(C2C=CC=CC=2)CCN(CC(NCCC2C=CC(=CC=2)F)=O)C1
|
|
| MCULE-6887454382 |
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CC1C=CC=C(CCC(N2[C@@H](C(=O)O)CCC2)=O)C=1
|
|
| MCULE-3487610308 |
0.69 |
CC1N(CC(C2=CC=CC=C2)O)CCN(C2C(=O)N(CC(O)=O)CCCC2)C1
|
|
| MCULE-7076014078 |
0.69 |
CC1C=C(C)C=C(CCC(N2[C@H](C(=O)O)CCC2)=O)C=1
|
|
| MCULE-2473871077 |
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N12CCN(C[C@@H]1C(=O)N[C@H]([C@H](C)O)C2=O)CCC1C=CC=CC=1
|
|
| MCULE-6913746860 |
0.69 |
CN1C(C(N2CCN(CC(C3=CC=CC=C3)O)CC2)=O)CCC1
|
|
| MCULE-5276784475 |
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CO[C@@H]1CN(CCC2=CC3=C(C=CC=C3)C=C2)[C@H](C(N)=O)C1
|
|
| MCULE-1821773079 |
0.69 |
C(=O)(CN1CCCCCC1)N[C@H](CO)CC1C=CC=CC=1
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|
| MCULE-8529225516 |
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NC([C@]1(NC(CC2=CC(C3CC3)=CC=C2)=O)C[C@@H](O)C1)=O
|
|
| MCULE-3080516196 |
0.69 |
CC(C(NC(C(N1CCCC1)=O)CC1C=CC=CC=1)=O)CN
|
|
| MCULE-7242117621 |
0.69 |
CN(C(CCCC(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)=O)C
|
|
| MCULE-6977491342 |
0.69 |
CC(CC(NC(C(N1CCCC1)=O)CC1C=CC=CC=1)=O)N
|
|
| MCULE-9610236748 |
0.69 |
CC(CCNC(C(NC(C12CC3CC(CC(C3)C1)C2)=O)CC1=CC=CC=C1)=O)N
|
|
| MCULE-5198493397 |
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CC1C=CC=C(CCC(N2C(C(=O)O)CCC2)=O)C=1
|
|
| MCULE-5088113785 |
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OC1CN([C@@H]2[C@H](NC(CC3=CC(C4CC4)=CC=C3)=O)CCC2)CC1
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|
| MCULE-3070945239 |
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CC1C=C(C)C=C(CCC(N2C(C(=O)O)(C)CCC2)=O)C=1
|
|
| MCULE-3095926330 |
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C(=O)(NCC1(CCCC1)COC)[C@H](CC1C=CC=CC=1)N(C)C
|
|
| MCULE-2915676488 |
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CC1=CC(CCC(N2[C@@H](C(O)=O)CCC2)=O)=CC=C1
|
|
| MCULE-2296983786 |
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C1(=O)N(CCCC1(CNCCNC(C)=O)O)CCC1=CC=CC=C1
|
|
| MCULE-8736900809 |
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CC1C=CC(CCC(NCC(N(C2CC2)CC(=O)O)=O)=O)=CC=1
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|
| MCULE-4415243308 |
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N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@H](CC1C=CC=CC=1)C2=O)C(=O)N1CCN(CC1)CCCN(C)C
|
|
| MCULE-4943903230 |
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CC1C=C(C)C=C(CCC(N2[C@@H](C(=O)O)CCC2)=O)C=1
|
|
| MCULE-9485937628 |
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N1(CC2CC2)CC(=O)N[C@@H](CC(C)C)COC2C=CC(C[C@@H](C(=O)N[C@@H](CC3C=CC(=CC=3)OC)C(=O)N[C@H](C)C1=O)NC(=O)[C@@H]1CCCN1)=CC=2
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|
| MCULE-1184564122 |
0.69 |
C(NC(C(=O)O)CC1C=CC=CC=1)(=O)C(NC(C(=O)O)CC1C=CC=CC=1)=O
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|
| MCULE-6351514064 |
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N1(CC2CC2)CC(=O)N[C@@H](CC(C)C)COC2=CC=C(C[C@@H](C(=O)N[C@@H](CC3=CC=C(C=C3)OC)C(=O)N[C@H](C)C1=O)NC(=O)[C@H]1CCCN1C)C=C2
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|
| MCULE-2106730413 |
0.69 |
CC1C=CC=C(CCC(N2C(C(=O)O)(C)CCC2)=O)C=1
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|
| MCULE-7864853761 |
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C(=O)(OC(C)(C)C)N[C@@H](CC1=CC=CC=C1)C(=O)NC[C@@H]1CC[C@H](CC1)C(=O)N[C@H](C(O)=O)CC(O)=O
|
|
| MCULE-5655568273 |
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[C@@H](NC([C@H](CO)NC(=O)[C@@H](N)CC(=O)O)=O)(C(=O)N[C@@H](C(C)C)C(=O)NCCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N)CCSC)CC1C=CC=CC=1
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|
| MCULE-2822809005 |
0.69 |
N1(CC2CC2)CC(=O)N[C@@H](CC(C)C)COC2=CC=C(C[C@@H](C(=O)N[C@@H](CC3=CC=C(C=C3)OC)C(=O)N[C@H](C)C1=O)NC(=O)[C@@H]1CCCN1C)C=C2
|
|
| MCULE-6323488505 |
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N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)OCC(=O)N[C@@H](C(C)C)C2=O)C(=O)N1CCC(CC1)OC1=CC=CC=C1F
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|
| MCULE-7763782093 |
0.69 |
O=C(C1COCC1)NC(CC1=CC=CC=C1)CN1CCCCC1
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|
| MCULE-9825598460 |
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N12CCC[C@H]1C(=O)NCCCC[C@H](NC(COC1=CC=C(C=C1)Cl)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
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|
| MCULE-3431221491 |
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CC(C[C@@H](C(=O)O)NC(CNC(CCC1C=CC=CC=1Br)=O)=O)C
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| MCULE-6281255329 |
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CO[C@@H]1CN(C(CC2=CC=C(C#N)C=C2)=O)[C@H](C(N)=O)C1
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|
| MCULE-2550380283 |
0.69 |
COC(C(CC1C=CC2C=CC=CC=2C=1)CNC(C1NCCC1)=O)=O
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|
| MCULE-3483941714 |
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N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(CC2=CC=CC(O)=C2)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
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| MCULE-9935521940 |
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N12CCC[C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CN(C(=O)CC1C=CC(=CC=1)C(F)(F)F)CC(=O)N[C@@H](C)C2=O)CC1=CC=CC=C1
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|
| MCULE-5128655070 |
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N1(C[C@H]([C@H](C(O)=O)C1)C1C=CC=CC=1C)C(=O)C1(CCCC1)N1CCCC1
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|
| MCULE-8632767762 |
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CN(C(C1C=CC=CC=1)CNC(CN1C(C(=O)O)CCC1)=O)C
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|
| MCULE-5000248702 |
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N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(C(=O)C2=CC=C(C=C2)CN(C)C)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-7406334060 |
0.69 |
C1(CC2C(=CC=CC=2)C1)(N1CCCCC1)C(=O)N1CCC[C@H]1C(N)=O
|
|
| MCULE-5199419956 |
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N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(C(=O)CC2=CC=CC(OC)=C2)CCNC(=O)[C@@H]1[C@@H](C)O)=O
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|
| MCULE-2339022955 |
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N1(C[C@H](CC2=CC=CC=C2)NC(=O)C1)C(=O)[C@@H]1CCCN2CCCC[C@]12[H]
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| MCULE-9349107728 |
0.69 |
[C@@H]1(C(O)=O)CN(C[C@H]1C1=CC=CC(F)=C1)C(=O)CN(C)CCOC
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|
| MCULE-2800528475 |
0.69 |
CCC(C1C=CC=CC=1)C(NCC1(NCCC1)COC)=O
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|
| MCULE-4386580566 |
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N1(C(=O)COC)[C@H](C(=O)N[C@H](CC2C=CC=CC=2)C(N)=O)C[C@H](CC1)NC(COC)=O
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|
| MCULE-2018177264 |
0.69 |
COCC1(NCCC1)CNC(C1(C2C=CC=CC=2)CC1)=O
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|
| MCULE-1595540296 |
0.69 |
COC(C1N(C(C2C(C3=CC=C(C(C)C)C=C3)C2)=O)CC(=O)NC1)=O
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|
| MCULE-8126941260 |
0.69 |
CN(CC1=CC=CC=C1)CC1CCN(C([C@@H]2N(C(C)=O)C[C@H](O)C2)=O)CC1
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|
| MCULE-5092482646 |
0.69 |
CN1C(=O)CN(C(C2CC3=C(C=CC=C3)CC2)=O)C(C(O)=O)C1
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|
| MCULE-8535424950 |
0.69 |
CC(C[C@@H](C(=O)O)NC(CNC(C1(C2C=CC(F)=CC=2)CC1)=O)=O)C
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|
| MCULE-7174260513 |
0.69 |
Cl.CO[C@H]1C[C@H](C(NCC(C2=CC=CC=C2)N2CCC(C)CC2)=O)NC1
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|
| MCULE-3172846600 |
0.69 |
CC1=C(CCNC(CN2CC(C(N)=O)(O)CCC2)=O)C=CC=C1
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|
| MCULE-3006772061 |
0.69 |
C1(C2=CC=CC(=C2)C(F)(F)F)(CC(=O)N2CCNC(=O)C2CC)CC(N(CC)C1=O)=O
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|
| MCULE-4790153827 |
0.69 |
OCC1CCN(CC(N2C(C(C3=CC=CC=C3)O)CCCC2)=O)CC1
|
|
| MCULE-1636831829 |
0.69 |
CO[C@@H]1CN(C(CC2=CC=C(C3=CC=CC=C3)C=C2)=O)[C@H](C(N)=O)C1
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|
| MCULE-2692059493 |
0.69 |
CC(CN(C(C1NC(=O)CC1)=O)CC(C1=CC=C(F)C=C1)O)C
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|
| MCULE-8052070188 |
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COC(C(NC([C@@H]1N(C)CCC1)=O)CC1=C(O)C=CC=C1)=O
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|
| MCULE-7568622120 |
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OC(C(F)(F)F)(C1=CC=CC=C1)CCNC([C@@H]1NC(=O)CC1)=O
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|
| MCULE-4666954136 |
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CCC1=C(CC(N2[C@H](C(N)=O)C[C@H](OC)C2)=O)C=CC=C1
|
|
| MCULE-5114280399 |
0.69 |
C(=O)(N(C)C)CN1CC[C@H]([C@H](O)C1)NC(CCC1C=CC(=CC=1)O)=O
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|
| MCULE-3257480777 |
0.69 |
CNC(C1(N(C(CCC2=CC=C(C#N)C=C2)=O)CCC1)COC)=O
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|
| MCULE-3892800440 |
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C1(CC2C(=CC=CC=2)C1)(N1CCCCC1)C(=O)N1CCN(CC1)CCO
|
|
| MCULE-3093405383 |
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O=C(NC(C(N1CCCC1)=O)CC1C=CC=CC=1)CC1NCCOC1
|
|
| MCULE-9028693867 |
0.69 |
COC([C@H](NC(CN1C(=O)CCC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-5371631529 |
0.69 |
CC(C1OCCC(NC(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)C1)C
|
|
| MCULE-1831273045 |
0.69 |
[C@@H]1(C(O)=O)CN(C[C@H]1C1C=CC=CC=1C)C(=O)CN(C)CCOC
|
|
| MCULE-9756088806 |
0.69 |
COC(C(CC1C=CC=C(C)C=1)CNC(C1NCCC1)=O)=O
|
|
| MCULE-4955929998 |
0.69 |
[C@H](CC(N1CCC[C@H]1[C@@H]([C@@H](C)C(N[C@H](C(OC)=O)CC1=CC=CC=C1)=O)OC)=O)(OC)[C@H]([C@@H](C)CC)N(C(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC)C
|
|
| MCULE-2156854067 |
0.69 |
N1(CC(CC1=O)C1=CC=CC=C1)CC(=O)N1CCC(CC1)(F)F
|
|
| MCULE-8177685127 |
0.69 |
CCCNC(C1(NC(CC(C2=CC=CC=C2)(C2CC2)O)=O)CCCCC1)=O
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|
| MCULE-7072273015 |
0.69 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(NC2CCC(=O)NCC2)=O)C1
|
|
| MCULE-2544528627 |
0.69 |
CC1=CC=C([C@@H](CNC(C23N(C4CC4)CC(C2)C3)=O)O)C=C1
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|
| MCULE-8045485465 |
0.69 |
CNC(C(NC[C@@H]1[C@@H](C(C)C)OCC1)CC1=CC=CC=C1)=O
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|
| MCULE-4859396910 |
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O=C([C@H](CC1C=CC=CC=1)NC(=O)[C@@H]([C@@H](OC)[C@@H]1CCCN1C(=O)C[C@H]([C@H]([C@H](CC)C)N(C(=O)[C@H](C(C)C)NC(=O)[C@H](C(C)C)NC)C)OC)C)OC
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|
| MCULE-2841904836 |
0.69 |
[C@H]1(CN(C[C@H]1C1C=CC=CC=1)CC(=O)N(C)C)C(O)=O
|
|
| MCULE-2499943210 |
0.69 |
OC(C1N(CC(NCC2(C3C=CC=CC=3)CCCC2)=O)CCCC1)=O
|
|
| MCULE-1447993030 |
0.69 |
C(C)(C)[C@@H](C(N[C@H](CCCCN)C(N[C@@H](C(NCC(N[C@@H](C(C)C)C(NCC(N[C@@H](C(N[C@@H](CCCCN)C(N[C@H](C(C)C)C(N[C@H](C(N[C@@H](C(C)C)C(N[C@@H](C(O)=O)CC1C=CC=CC=1)=O)=O)CCSC)=O)=O)=O)CC1C=CC=CC=1)=O)=O)=O)=O)CC1C=CC=CC=1)=O)=O)N
|
|
| MCULE-4657990457 |
0.69 |
N12CCCC[C@]1([H])[C@@H](CCC2)CCC(=O)N[C@@H](CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-8900424313 |
0.69 |
CC(N1[C@@H](C(N2CC3(CCN(CC4=CC=CC=C4)CC3)CC2)=O)C[C@H](O)C1)=O
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|
| MCULE-7083569809 |
0.69 |
CC(C1C=CC=CC=1)(CC(NC(C(=O)O)CC1C=CC=CC=1)=O)C
|
|
| MCULE-5581294958 |
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O=C(C(NC(C1C2CC(CC2)C1)=O)CC1=CC=CC=C1)NC1CC1
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|
| MCULE-2037693030 |
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C1(C2C=CC(=CC=2)C)(CC1)C(=O)N[C@@H]1CCN(C[C@H]1O)CC(=O)N(C)C
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|
| MCULE-1671483663 |
0.69 |
CCCN(CC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)C
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|
| MCULE-8052392670 |
0.69 |
CCC(C1C=CC=CC=1)CC(NC(C(=O)O)CCOC)=O
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|
| MCULE-2782578952 |
0.69 |
C1=CC=C(C=C1)CC(C(O)=O)N1C(=O)C(CC1=O)CC1C=CC(=CC=1)C
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|
| MCULE-2978217604 |
0.69 |
CN(C(CCC1C=CC=CC=1)=O)C(C(=O)O)CC1C=CC=CC=1
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|
| MCULE-9965432891 |
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C(=O)(NC(C)C)C(=O)NCC(O)(C1C=CC=CC=1)C1CC1
|
|
| MCULE-3402138253 |
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CN(C(C1N(C(CCC2=C(O)C=CC=C2)=O)[C@@H]2[C@@H](OCC2)C1)=O)C
|
|
| MCULE-8249302129 |
0.69 |
CC(C1C=CC=CC=1)CC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O
|
|
| MCULE-1461924548 |
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N1(C[C@H](CC2=CC=CC=C2)NC(=O)C1)C(CCCN1CCCCCC1)=O
|
|
| MCULE-8252596585 |
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FC1=C(CCC(N2[C@@H]3[C@@H](OCC3)C[C@H]2C(NC2CC2)=O)=O)C=CC=C1
|
|
| MCULE-1460398978 |
0.69 |
C(=O)(NCC1(C)COC1)[C@H](CC1C=CC=CC=1)N(C)C
|
|
| MCULE-6898577172 |
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CC(C1CNCCC1)CC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O
|
|
| MCULE-8211389584 |
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CC(C[C@@H](C(=O)O)NC(CNC(C1(CCC1)CC1C=CC=C(F)C=1)=O)=O)C
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|
| MCULE-9891465249 |
0.69 |
CC(C(NC(C(=O)O)CC1C=CC=CC=1)=O)(CC1C=CC=CC=1)C
|
|
| MCULE-9351564317 |
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CCC1(C(N2C[C@@H](C3C=CC=CC=3)[C@H](N)C2)=O)NCCC1
|
|
| MCULE-3638107556 |
0.69 |
CC(C1C=CC=C(F)C=1)CC(N(CC(N1CC(C(=O)O)CCC1)=O)C)=O
|
|
| MCULE-6213421613 |
0.69 |
[H][C@](C(N[C@](C(=O)O)(CC1C=CC=CC=1)[H])=O)(N)C
|
|
| MCULE-4020098201 |
0.69 |
COCCC(C(=O)O)NC(CC(C1C=CC=CC=1)C(C)C)=O
|
|
| MCULE-4287790759 |
0.69 |
CC(C(N1C(C(O)=O)CN(C)C(=O)C1)=O)CC1=CC(Cl)=CC=C1
|
|
| MCULE-1803376127 |
0.69 |
CC(C1C=CC=CC=1)CC(N(C(C(=O)O)CC1C=CC=CC=1)C)=O
|
|
| MCULE-8591784420 |
0.69 |
C12(CC3CC(CC)(CC(C3)(O)C1)C2)C(=O)N1CCN(C(=O)C1)CCC1C=CC=CC=1
|
|
| MCULE-7794341443 |
0.69 |
CC1(OCCC1)CNC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O
|
|
| MCULE-7262291750 |
0.69 |
CC(C1C=CC=CC=1)CC(NC(C(=O)O)CC1C=CC=CC=1)=O
|
|
| MCULE-9680659930 |
0.69 |
N1[C@@H](C(C)C)C(=O)N(C)CC(=O)N[C@@H](CC2=CC=CC=C2)C(NCCCN(C(=O)CN2CCCCC2)[C@H](C)C1=O)=O
|
|
| MCULE-9306838076 |
0.69 |
CC(C[C@@H](C(=O)O)NC(CNC(C1(C2C=CC=CC=2)CCOCC1)=O)=O)C
|
|
| MCULE-3186024561 |
0.69 |
C(O)(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](C)N
|
|
| MCULE-3509657907 |
0.69 |
C(=O)(C1(C2=CC=CC=C2)CCN(CC1)C(=O)OC(C)(C)C)N1CCC[C@H]1C(=O)N[C@H](C)C(O)=O
|
|
| MCULE-6840224727 |
0.69 |
CC1C=CC(CCC(NCC(NC2(C(=O)O)CCOCC2)=O)=O)=CC=1
|
|
| MCULE-7649675427 |
0.69 |
CC1CN(C(CN2CCN(C(C(CC3C=CC=CC=3)N)=O)CC2)=O)CC(C)C1
|
|
| MCULE-7732990015 |
0.69 |
C(=O)(C1(C2=CC=CC=C2)CCN(CC1)C(=O)OC(C)(C)C)N1CCC[C@H]1C(=O)N[C@@H](C)C(O)=O
|
|
| MCULE-1367038380 |
0.69 |
CCOC1CN(C(CNC(CCC2=CC=C(C)C=C2)=O)=O)CCC1
|
|
| MCULE-7615696333 |
0.69 |
OC(C(NC(CCC1=CC=CC=C1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-7620411874 |
0.69 |
C(=O)(C1(C2=CC=CC=C2)CCN(CC1)C(=O)OC(C)(C)C)N1CCCC1C(=O)NC(C)C(O)=O
|
|
| MCULE-1223101992 |
0.69 |
N1(CCCNC(=O)[C@H](CC2=CC=CC=C2)NC(CN(C)C(=O)[C@H](C(C)C)NC(=O)[C@H]1C)=O)C(C1CCOCC1)=O
|
|
| MCULE-6642840786 |
0.69 |
CC(C1C=CC=CC=1)(CC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)C
|
|
| MCULE-5079454271 |
0.69 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(C(=O)COC2=CC=C3C(C=CC=C3)=C2)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-5945335131 |
0.69 |
CCC1(COC1)CN1C(=O)C(CC2=CC=CC=C2)NC1=O
|
|
| MCULE-9368163463 |
0.69 |
C[C@H](C(NC(C(NC1CC1)=O)CC1C=CC=CC=1)=O)N
|
|
| MCULE-1583735087 |
0.69 |
O=C(C1NCCC1)NCC1(C2C=CC=CC=2)CCOCC1
|
|
| MCULE-5427585145 |
0.69 |
CN1C(C(NC(C2=CC=CC=C2)CCCO)=O)(C)CC(O)C1
|
|
| MCULE-7940752719 |
0.69 |
CC([C@@H](C(NCC(NC(C(NC1CC1)=O)CC1C=CC=CC=1)=O)=O)N)C
|
|
| MCULE-4471094782 |
0.69 |
OC(C1N(C(CNC(CC2C=CC=CC=2)=O)=O)CCCC1)=O
|
|
| MCULE-1894884837 |
0.69 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(CC1=CC=CC(F)=C1)=O)C
|
|
| MCULE-5865350709 |
0.69 |
NC(C(NCC(N1CCCCC1)=O)=O)CC1C=CC=CC=1
|
|
| MCULE-4492740011 |
0.69 |
CC1CC(C(=O)O)N(C(CNC(CC2C=CC=CC=2)=O)=O)CC1
|
|
| MCULE-1169026903 |
0.69 |
N1(C)C[C@H](C[C@H]1C(O)=O)NC(CC1C=CC(=CC=1)C)=O
|
|
| MCULE-4004062260 |
0.69 |
OC([C@H](NC(CCC1=CC=CC=C1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-7963689067 |
0.69 |
N1(C(CC2=CC=CC=C2)C(=O)NC2CCCCC2)C(=O)C2C(C3CC2CC3)C1=O
|
|
| MCULE-7180836170 |
0.69 |
CC(C(N(CC(N1CC(C(O)=O)CCC1)=O)C)=O)CC1=CC(F)=CC=C1
|
|
| MCULE-2487451837 |
0.69 |
OC([C@H](NC(CCC1C=CC=CC=1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-9511800002 |
0.69 |
[C@]1(CCCN2CCCC[C@@]21[H])(O)CN[C@@H](CC1=CC=CC=C1)C(N)=O
|
|
| MCULE-1417745362 |
0.69 |
[C@H](C(=O)N[C@H](C(=O)N)CCCCN)(NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](C(C)C)NC(=O)C)CC1C=CC(O)=CC=1
|
|
| MCULE-4841211467 |
0.69 |
N1(C[C@H](CC2=CC=CC=C2)NC(=O)C1)C(=O)CN(C)C1CCCC1
|
|
| MCULE-9509745134 |
0.69 |
N1(C[C@H](CC2=CC=CC=C2)NC(=O)C1)C(CCCC1=CC=C(C=C1)F)=O
|
|
| MCULE-5121143337 |
0.69 |
CN1C(C(N2CC(OCCCC3=CC=CC=C3)C2)=O)(C)CC(O)C1
|
|
| MCULE-3596219377 |
0.69 |
O=C(NC(C(NC1CC1)=O)CC1=CC=CC=C1)CNC(C1CC1)=O
|
|
| MCULE-5736784955 |
0.69 |
CC(C[C@@H](C(=O)O)NC(CNC(CCC1C=CC(C)=CC=1C)=O)=O)C
|
|
| MCULE-6186580574 |
0.69 |
C(C(C)N)(=O)NC(CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-4467799825 |
0.69 |
OC[C@@H](NC(C1(N2CCOCC2)CCC1)=O)CC1=CC=CC=C1
|
|
| MCULE-5609359083 |
0.69 |
O=C(C(F)(F)F)O.O=C([C@H](N)CC1C=CC=CC=1)N1CCC[C@H]1C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)NCC(=O)NCC(=O)NCC(=O)NCC(=O)N[C@H](C(=O)NCC(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N1CCC[C@H]1C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)N[C@H](C(=O)O)CC(C)C)CC1C=CC(O)=CC=1)CCC(=O)O)CCC(=O)O)[C@H](CC)C)CCC(=O)O)CCC(=O)O)CC1C=CC=CC=1)CC(=O)O)CC(=O)N)CCCNC(=N)N
|
|
| MCULE-8221957549 |
0.69 |
N1(CCC[C@H]1C(=O)NCC1(C2C=CC=CC=2)CCN(CC1)C)C(N)=O
|
|
| MCULE-8915550502 |
0.69 |
N1(CCC[C@H]1C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CCC(O)=O)C(=O)N[C@@H](CC1C=CC(O)=CC=1)C(=O)N[C@@H](CC(C)C)C(O)=O)C(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CCC(O)=O)NC(=O)[C@H](CC1C=CC=CC=1)NC(=O)[C@@H](NC(CNC(=O)[C@@H](NC(CNC(CNC(CNC(CNC(=O)[C@@H]1CCCN1C(=O)[C@H](CCCNC(N)=N)NC(=O)[C@@H]1CCCN1C(=O)[C@H](N)CC1=CC=CC=C1)=O)=O)=O)=O)CC(N)=O)=O)CC(O)=O.C(F)(F)(F)C(O)=O
|
|
| MCULE-2552985880 |
0.69 |
CCCN1C(C(NC(CC2C=CC=CC=2)CCC(=O)O)=O)CCC1
|
|
| MCULE-1039389508 |
0.69 |
C(=O)(N(C)CC1CCN(CC1)CCC1C=CC(=CC=1)OC)[C@@H]1C[C@H](CN1)O
|
|
| MCULE-1536056160 |
0.69 |
O=C(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)CC1NCCC1
|
|
| MCULE-9735499487 |
0.69 |
C1(C=CC=CC=1)C[C@@H](C(=O)O)NC(=O)[C@@H](N)CCCNC(=N)N.C(=O)(O)C
|
|
| MCULE-9322407915 |
0.69 |
N1(CCC2=CC=C(C=C2)C)C(=O)CCC1(C)C(NCCCOCC)=O
|
|
| MCULE-4845151083 |
0.69 |
Cl.COC1=CC(CCNC(C2NCC(O)C2)=O)=CC=C1
|
|
| MCULE-3008489746 |
0.69 |
N1(CCC(O)(C2=CC=CC=C2)C1)C(=O)CCN1CCN(CC1)C
|
|
| MCULE-6480733929 |
0.69 |
N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1C=CC(=CC=1)OC)C(=O)[C@@H]1CCC(=O)N1
|
|
| MCULE-2548705730 |
0.69 |
OC([C@@H]1N(C(CNC(CC2C=CC=CC=2)=O)=O)CCCC1)=O
|
|
| MCULE-3330975093 |
0.69 |
CC(C(N1C(C(O)=O)CN(C)C(=O)C1)=O)CC1=C(F)C=CC=C1
|
|
| MCULE-5411756676 |
0.69 |
COC(CC(N1C(CC2=CC=CC=C2)C(=O)NCCC1)=O)(C)C
|
|
| MCULE-3996747775 |
0.69 |
[O-]C(C1N(C2CC2)C(C(NC2CC3=C(C=CC=C3)C2)=O)CC1)=O
|
|
| MCULE-2807751503 |
0.69 |
FC(C1=CC=C([C@H]2[C@H](NC([C@H]3NC(=O)CC3)=O)C2)C=C1)(F)F
|
|
| MCULE-5264460054 |
0.69 |
CO[C@H]1C[C@@H](C(NCC(C2=C(F)C=CC=C2)(C)C)=O)NC1
|
|
| MCULE-4102678472 |
0.69 |
C[C@H]1N(C(CN(C(=O)C)CCC2C=CC=CC=2)=O)CCC[C@H]1C(=O)O
|
|
| MCULE-4618198009 |
0.69 |
CC(NC(CN1C(=O)CCCCC1)=O)(CC1=C(F)C=CC=C1)CO
|
|
| MCULE-1762687323 |
0.69 |
N1[C@H](C(C)C)C(=O)NCCCN(CCCC(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N[C@H](C)C1=O)C(CCC(C)C)=O
|
|
| MCULE-9006250831 |
0.69 |
CN1C(C(NCCC2=CC(CO)=C(O)C=C2)=O)(C)CC(O)C1
|
|
| MCULE-5065701719 |
0.69 |
FC1=CC(C2CN(C(C3N(C(C4CC4)=O)CCC3)=O)CC2)=CC=C1
|
|
| MCULE-4722262146 |
0.69 |
C(NC(=O)CCCCCCCCCCCCCCC)(CN1CCOCC1)C(O)C1C=CC=CC=1
|
|
| MCULE-2145605044 |
0.69 |
OC(C1N(CC(NCCC2C=CC=CC=2)=O)C2C(CCCC2)C1)=O
|
|
| MCULE-8728529600 |
0.69 |
CC(C1=CC=C(CNC([C@@H]2N(C(C)=O)C[C@H](O)C2)=O)C=C1)C
|
|
| MCULE-5077192854 |
0.69 |
OC1CN([C@@H]2[C@H](NC(C3(CC3)CC3=CC=C(F)C=C3)=O)CCC2)CC1
|
|
| MCULE-4310108239 |
0.69 |
C1(C=CC=CC=1)C[C@@H](C(=O)O)NC(=O)[C@@H](N)CCCNC(=N)N
|
|
| MCULE-7566810276 |
0.69 |
CC1C(C(NCCC(NC(C(N2CCCC2)=O)CC2=CC=CC=C2)=O)=O)C1
|
|
| MCULE-9231271374 |
0.69 |
CCCCCCCCCC(=O)NC(C(C1C=CC=CC=1)O)CN1CCOCC1
|
|
| MCULE-1425030455 |
0.69 |
CC(C[C@@H](C(=O)O)NC(CNC(CCC1C=CC(Cl)=CC=1)=O)=O)C
|
|
| MCULE-4032381986 |
0.69 |
CO[C@@H]1C[C@H](C(NCC(C2=CC(F)=CC=C2)(C)C)=O)NC1
|
|
| MCULE-3780387959 |
0.69 |
N1(C(CC2=CC=CC=C2)C(=O)N2CCCCC2C)C(=O)C2C(CCCC2)C1=O
|
|
| MCULE-5716644471 |
0.69 |
CC(NC(CN1C(=O)CCCCCC1)=O)(CC1=C(F)C=CC=C1)CO
|
|
| MCULE-4200288534 |
0.69 |
CC(N(CC(N1C(CC(=O)O)CCC1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-6870710495 |
0.69 |
CC1(NC(CN2C(=O)C(O)CCCC2)=O)CC2=C(C=CC=C2)C1
|
|
| MCULE-1363410790 |
0.69 |
C(CC(C)C)(NC(CNC(CCC1=CC=CC=C1)=O)=O)C(OC)=O
|
|
| MCULE-8165202066 |
0.69 |
C12CN(C(CCC3=CC=CC=C3)=O)C(C(=O)N1CCN(CCOC)C2=O)CC1=CC=CC=C1
|
|
| MCULE-5285321558 |
0.69 |
CCCC(C(O)=O)NCC(NCC1(C2=CC=CC=C2)CCCCC1)=O
|
|
| MCULE-4334155929 |
0.69 |
C1(CC2C(=CC=CC=2)C1)(N1CCN(CC1)CC)C(=O)N1CCC(COC)C1
|
|
| MCULE-8004293209 |
0.69 |
CC[C@@H]([C@@H](C(=O)O)NCC(NCC1(C2C=CC=CC=2)CCCCC1)=O)C
|
|
| MCULE-8993996649 |
0.69 |
N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1C=CC(=CC=1)OC)C(=O)[C@H]1CCC(=O)N1
|
|
| MCULE-2937188991 |
0.69 |
N1(CCC2=CC=C(C=C2)C)C(=O)CCC1(C)C(NCCCOC(C)C)=O
|
|
| MCULE-3542354752 |
0.69 |
COC1=C(CCNC(C2(N(C)CC(O)C2)C)=O)C=CC=C1
|
|
| MCULE-8190059278 |
0.69 |
CCCC(C(N1CCC(OC)CCC1)=O)NC(CC1=CC=CC=C1)=O
|
|
| MCULE-3376510940 |
0.69 |
CCC1=CC=C(C(NC([C@@H]2N(C(C)=O)C[C@H](O)C2)=O)C)C=C1
|
|
| MCULE-4305935685 |
0.69 |
CC1=CC(C2(CCCC2)CNC(C2NC(=O)CC2)=O)=CC=C1
|
|
| MCULE-8648178299 |
0.69 |
[C@@H]12CN(C(CCC3=CC=CC=C3)=O)[C@H](C(=O)N1CCN(CCOC)C2=O)CC1=CC=CC=C1
|
|
| MCULE-8975135173 |
0.69 |
CC(COCCC(NC(C(NC1CC1)=O)CC1=CC=CC=C1)=O)C
|
|
| MCULE-9213260631 |
0.69 |
C(N)C(N[C@@H](C(NCC(N[C@H](CCCNC(N)=N)C(N[C@H](CC(C)C)C(N[C@@H](C(N[C@H](C(N[C@@H](C(NCC(N[C@@H](CC(C)C)C(N)=O)=O)=O)CC1C=CC=CC=1)=O)C)=O)CC1C=CC(O)=CC=1)=O)=O)=O)=O)CC(O)=O)=O
|
|
| MCULE-5811552630 |
0.69 |
NCCCOC1CCN(C(C2N(C(CC3C=CC=CC=3)=O)CCC2)=O)CC1
|
|
| MCULE-6455979987 |
0.69 |
CC(C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)CN)CCCNC(=N)N)CC(C)C)CC1C=CC(O)=CC=1)C)CC1C=CC=CC=1)C(=O)N)C
|
|
| MCULE-6620904005 |
0.69 |
C(=O)(C(CC(C)C)NC(=O)C(CC1C=CC=CC=1)NC(CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(C=C1)O)=O)NC(CCC(C)NC(N)=N)C(O)=O
|
|
| MCULE-3161495817 |
0.69 |
C(=O)([C@@H]1C[C@H](CN1)O)N1CCC2(CC1)CC1C=CC=C(C=1)OC1=CC(=CC=C1)CCNC2=O
|
|
| MCULE-2027416015 |
0.69 |
N12CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)OCC(=O)N[C@H](C(C)C)C2=O)C(O)=O
|
|
| MCULE-5490733596 |
0.69 |
CC(C[C@H](NC(=O)CNC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)[C@@H](NC(=O)CNC(=O)[C@H](CC(=O)O)NC(=O)CN)CCCNC(=N)N)CC(C)C)CC1C=CC(O)=CC=1)C)CC1C=CC=CC=1)C(=O)N)C
|
|
| MCULE-4623769088 |
0.69 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)OCC(=O)N[C@@H](C(C)C)C2=O)C(O)=O
|
|
| MCULE-6752975327 |
0.69 |
C(=O)(OC(C)(C)C)N1CCCC1C(=O)NC(CC1=CC=CC=C1)C(=O)NC(CC(C)C)C(OC)=O
|
|
| MCULE-5021707616 |
0.69 |
CN(C(C1C(C2C=CC=C3C=2C=CC=C3)C1)=O)CC(N1CC(C(=O)O)CCC1)=O
|
|
| MCULE-9347503562 |
0.69 |
CC(C[C@@H](C(=O)O)NC(CNC([C@H](C1C=CC=CC=1)C)=O)=O)C
|
|
| MCULE-6550366927 |
0.69 |
OC[C@@H]1N(C(CCC2=C(F)C=C(F)C=C2)=O)C[C@H]2N(CCC2)C1
|
|
| MCULE-8964802339 |
0.69 |
CC(C[C@@H](C(=O)O)NC(CNC(C(C1C=CC=CC=1)(C)C)=O)=O)C
|
|
| MCULE-9080451412 |
0.69 |
CO[C@@H]1CN(C)[C@H](C(N2CCC(CC3=CC=CC=C3)(CO)CC2)=O)C1
|
|
| MCULE-7072953970 |
0.69 |
CC(C(C(NCC(CC1=CC=CC=C1)O)=O)N1C(=O)CCC1)C
|
|
| MCULE-4285309631 |
0.69 |
N1(C[C@@H](C[C@H]1C(O)=O)O)C(=O)C1CC2=C(C=CC=C2)C1
|
|
| MCULE-7775624807 |
0.69 |
CN(C(CCC1C=CC=C(C)C=1)=O)CC(N1CCC(C(=O)O)CC1)=O
|
|
| MCULE-6517071544 |
0.69 |
CCC(C1C=CC=CC=1)(C(=O)O)CNC(CNC(CCC1C=CC(C)=CC=1)=O)=O
|
|
| MCULE-8150198581 |
0.69 |
N1(CC[C@H]([C@H](O)C1)C1=CC=C2C(C=CC=C2)=C1)C(=O)CN1CCCC1
|
|
| MCULE-4727839521 |
0.69 |
N1(CC(C)O)C(=O)[C@@H](NC1=O)CC1=CC=CC=C1
|
|
| MCULE-6617054559 |
0.69 |
CCN1C(=O)C(=O)N(CC(N[C@@H](C(=O)O)CC2C=CC=CC=2)=O)CC1
|
|
| MCULE-4753184110 |
0.69 |
CCCC(C1C=CC=CC=1)C(N(CC(N1CC(C(=O)O)CCC1)=O)C)=O
|
|
| MCULE-8718992633 |
0.69 |
CC(C[C@@H](C(=O)O)NC(CNC([C@@H](C1C=CC=CC=1)C)=O)=O)C
|
|
| MCULE-5781083630 |
0.69 |
C(OCC)(=O)CNC([C@@H]1CCCN1C(CC1=CC=CC=C1)=O)=O
|
|
| MCULE-4301667407 |
0.69 |
CC(C(C(N1CC(CO)(CO)CC1)=O)NC(CC1=CC2=C(C=CC=C2)C=C1)=O)C
|
|
| MCULE-8545078553 |
0.69 |
N1[C@@H](C2CC2)C(=O)N[C@@H](CC2=CC=C(C=C2)OC)C1=O
|
|
| MCULE-2611160354 |
0.69 |
CC(C[C@@H](C(=O)O)NC(CNC(CC1C=CC=CC=1)=O)=O)C
|
|
| MCULE-2186221635 |
0.69 |
CC(C1C=CC=CC=1C)CC(N(CC(N1CC(C(=O)O)CCC1)=O)C)=O
|
|
| MCULE-4548237560 |
0.69 |
OCCC(C1C=CC=CC=1)CNC(C1NCCCC1)=O
|
|
| MCULE-2140804937 |
0.69 |
OC(C1N(C(C2C3C=CC=CC=3C2)=O)CCC1)=O
|
|
| MCULE-3346181253 |
0.69 |
CC(NCCCCCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)=O
|
|
| MCULE-9893552002 |
0.69 |
CN(C(CCC1C=CC=CC=1C)=O)CC(N1CC(C(=O)O)CCC1)=O
|
|
| MCULE-8940728967 |
0.69 |
O=C(NC1C(C2=CC=CC=C2)C1)CN1C(=O)CCCCCC1
|
|
| MCULE-6244606000 |
0.69 |
CC(C1=CC=C(CC2CN(C(C3N(C4CC4)C(C(O)=O)CC3)=O)CC2)C=C1)C
|
|
| MCULE-4363510273 |
0.69 |
CCCC(C(=O)O)NC(CNC(CC1C=CC=CC=1)=O)=O
|
|
| MCULE-3950999757 |
0.69 |
CN(C(C(C1C=CC=CC=1)C1CC1)=O)CC(N1CC(C(=O)O)CCC1)=O
|
|
| MCULE-6128552834 |
0.69 |
CC(CC(C(O)=O)NC(CNC(CC1=CC=CC=C1)=O)=O)C
|
|
| MCULE-1910878644 |
0.69 |
O=C(CNC(=O)[C@@H]1CCCN1C(=O)CC1C=CC=CC=1)OCC
|
|
| MCULE-4512240197 |
0.69 |
CC[C@@H]([C@@H](C(=O)O)NC(CNC(CC1C=CC=CC=1)=O)=O)C
|
|
| MCULE-2240980984 |
0.69 |
OC1C(=O)N(CC(N(C2CC2)CCC2=CC=C(F)C=C2)=O)CCCC1
|
|
| MCULE-7492964927 |
0.69 |
CN(C(CCC1C=CC2C=CC=CC=2C=1)=O)CC(N1CCC(C(=O)O)CC1)=O
|
|
| MCULE-9391081879 |
0.69 |
CN(C(C1(CCC1)CC1C=CC=CC=1)=O)CC(N1CC(C(=O)O)CCC1)=O
|
|
| MCULE-4991732523 |
0.69 |
CC(CCC(NCC(N1C[C@@H](C2C=CC=CC=2)[C@H](N)C1)=O)=O)C
|
|
| MCULE-7758505933 |
0.69 |
N1(CCCC1C(=O)NCC(OCC)=O)C(=O)CC1C=CC=CC=1
|
|
| MCULE-1561838796 |
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CN(C(CCC1=CC(C)=CC(C)=C1)=O)CC(N1CCC(C(O)=O)CC1)=O
|
|
| MCULE-8385705080 |
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CCC(C(C1C=CC=CC=1)C(N(CC(N1CC(C(=O)O)CCC1)=O)C)=O)C
|
|
| MCULE-1006468695 |
0.69 |
CC(C[C@H](C(=O)O)NC(CNC(CC1C=CC=CC=1)=O)=O)C
|
|
| MCULE-4519088645 |
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N12C[C@@H](C[C@H]1C(N(CC1C=CC=CC=1)CC2=O)=O)O
|
|
| MCULE-2183910945 |
0.69 |
CCCC(C(=O)O)(NC(CNC(CC1C=CC=CC=1)=O)=O)C
|
|
| MCULE-8573244331 |
0.69 |
C1(O)(CCN(CC(=O)N(C)C2CCCCC2)C1)C1C=CC=CC=1C
|
|
| MCULE-6828032105 |
0.69 |
CN(C(CNC(CC1C=CC=CC=1)=O)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-5351709138 |
0.69 |
CC(CC1C=CC(CC(N(CC(N2CC(C(=O)O)CCC2)=O)C)=O)=CC=1)C
|
|
| MCULE-5683306495 |
0.69 |
CCC(N1C(C(N2CC(CC3=CC=CC=C3)NCC2)=O)CCCC1)=O
|
|
| MCULE-3841004150 |
0.69 |
CC1(C(=O)O)N(C(C2C3C=CC=CC=3C2)=O)CCC1
|
|
| MCULE-6703459343 |
0.69 |
CC1C=CC(CCC(NCC(NCCCCC(=O)O)=O)=O)=CC=1
|
|
| MCULE-1465195979 |
0.69 |
OC(C1=CC=C(F)C=C1)CNC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O
|
|
| MCULE-8146521697 |
0.69 |
OC(C(NC(CN1C(=O)CCCCC1)=O)CC1C=C(Cl)C=C(Cl)C=1)=O
|
|
| MCULE-4405548148 |
0.69 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(NCCC2=CC=NC=C2)=O)C1
|
|
| MCULE-7388366115 |
0.69 |
CN1C(C(N2CC(C3=CC=CC=C3)OCC2)=O)(C)CC(O)C1
|
|
| MCULE-9679975628 |
0.69 |
CC(C(C1C=CC=CC=1)C)NC(C1NCCC1)=O
|
|
| MCULE-7243626121 |
0.69 |
N1(C)C[C@@H](C[C@H]1C(O)=O)NC(=O)C1CC2=C(C=CC=C2)C1
|
|
| MCULE-3754310086 |
0.69 |
C(C)(C)C[C@H]1C(=O)N2C[C@H](O)C[C@@]2([H])C(=O)N1
|
|
| MCULE-1544126991 |
0.69 |
[C@@H]1(C(O)=O)CN(C[C@H]1C1=CC=CC(F)=C1)C(=O)CN(C)C1CCCC1
|
|
| MCULE-2992161826 |
0.69 |
CC(CC(C(N(C)C)=O)NC(CCC1=CC=CC=C1)=O)C
|
|
| MCULE-7926716777 |
0.69 |
CN1C(C(N2CC(C3=CC=CC=C3)(C)OCC2)=O)(C)CC(O)C1
|
|
| MCULE-6199623414 |
0.69 |
C1(CC(C)C)C(=O)N2CC(O)CC2C(=O)N1
|
|
| MCULE-6485099924 |
0.69 |
CC(C(N1CCCCC1)=O)NC(CN1C[C@]2(C3=CC=CC=C3)[C@@H](COC2)C1)=O
|
|
| MCULE-1169208308 |
0.69 |
CC(C(N1CC(C2=CC=CC=C2)CC1)=O)NC(C(C)(C)C)=O
|
|
| MCULE-1285343008 |
0.69 |
C1(CC2C(=CC=CC=2)C1)(N1CCCCC1)C(=O)N1CCCC(OC)C1
|
|
| MCULE-4135206510 |
0.69 |
CC(C(C1C=CC=CC=1)(C)C)NC([C@H]1NCCC1)=O
|
|
| MCULE-4951749201 |
0.69 |
OC1CC(C(N2CC(C3=CC=CC=C3)OCC2)=O)NC1
|
|
| MCULE-1729643647 |
0.69 |
CC(C(C1C=CC=CC=1)(C)C)NC(C1NCCC1)=O
|
|
| MCULE-3397079938 |
0.69 |
C1(N(C)CCC2C=CC=CC=2)(CC2C(=CC=CC=2)C1)C(=O)N1CCCC(OC)C1
|
|
| MCULE-8897936761 |
0.69 |
CNC(C1(N(C(CC2=C3C(C=CC=C3)=CC=C2)=O)CCC1)COC)=O
|
|
| MCULE-2486213260 |
0.69 |
N1(C)C[C@H](C[C@H]1C(O)=O)NC(=O)C1CC2=C(C=CC=C2)C1
|
|
| MCULE-3411701521 |
0.69 |
[H]Cl.CCCCCCCCCC(=O)NC(C(C1C=CC=CC=1)O)CN1CCOCC1
|
|
| MCULE-8363720600 |
0.69 |
N1(C[C@H]([C@H](C(O)=O)C1)C1=CC=C(C=C1)F)C(=O)CN1[C@@H](C)CCC[C@H]1C
|
|
| MCULE-1256496674 |
0.69 |
CC(N1C(C(N2CC(C)(C)C(C3=CC=CC=C3)C2)=O)COCC1)=O
|
|
| MCULE-8755477996 |
0.69 |
O=C(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)COC1CCCC1
|
|
| MCULE-5471094256 |
0.69 |
CC1=CC=C(CCN(C(C2NC(=O)CC2)=O)CC2OCCC2)C=C1
|
|
| MCULE-6903139224 |
0.69 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N[C@H]2CCO[C@@H]([C@H]2O)CN(C(COC)=O)CC(=O)N[C@H](CC(C)C)C1=O
|
|
| MCULE-2437045303 |
0.69 |
[C@H]1(CN(C[C@H]1C1=CC=C(C=C1)F)CC(=O)N1CCCCCC1)C(O)=O
|
|
| MCULE-8345476559 |
0.69 |
C(C1C=CC(O)=CC=1)[C@@H](N)C(NCC(N[C@@H](CCCNC(N)=N)C(N[C@@H](CCCCN)C(N[C@@H](CCCCN)C(N[C@H](CCCNC(N)=N)C(N[C@@H](CCCNC(N)=N)C(N[C@H](CCC(N)=O)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CCCNC(N)=N)C(N[C@H](CCCNC(N)=N)C(N[C@H](C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CO)C(N[C@H](CCCNC(N)=N)C(N[C@H](CC(C)C)C(N[C@@H](C(N[C@@H](CCC(O)=O)C(N[C@@H](CC(C)C)C(N[C@@H](CCCNC(N)=N)C(NCC(N[C@@H](C(C)C)C(N1[C@H](CCC1)C(N[C@@H](CCCNC(N)=N)C(NCC(N[C@@H](CC(C)C)C(O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)C)=O)=O)=O)=O)=O)C)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O
|
|
| MCULE-2983818882 |
0.69 |
CNC(C1(N(C(CC2=CC3=C(C=CC=C3)C=C2)=O)CCC1)COC)=O
|
|
| MCULE-6917505023 |
0.69 |
N12CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@@H](CCC1C=CC=CC=1)C2=O)C(=O)N1CCC(CC1)COC
|
|
| MCULE-3908659591 |
0.69 |
OC(C1=CC=CC=C1)CN1C(=O)C(CC2=CC=CC=C2)NC1=O
|
|
| MCULE-8959247852 |
0.69 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@H](CC1C=CC=CC=1)C2=O)C(=O)NCC1CCOCC1
|
|
| MCULE-3748140838 |
0.69 |
Cl.CO[C@H]1C[C@@H](C(NCC(C2=C(F)C=CC=C2)(C)C)=O)NC1
|
|
| MCULE-8973355658 |
0.69 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@@H](C(C)C)C2=O)C(=O)NCC1CCOCC1
|
|
| MCULE-5638652294 |
0.69 |
C(NC(=O)CCCCCCCCCCCCCCC)(CN1CCOCC1)C(O)C1C=CC=CC=1.Cl
|
|
| MCULE-9004670686 |
0.69 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(C1=CC=NC=C1)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
|
|
| MCULE-1893225377 |
0.69 |
CN1C(C(N2CCC(CC3=C(F)C=CC=C3)(O)CC2)=O)(C)CC(O)C1
|
|
| MCULE-5310806303 |
0.69 |
CCCCC(C(=O)O)NC(CNC(CC1C=CC=CC=1)=O)=O
|
|
| MCULE-3151125756 |
0.69 |
CC(C(NC(C(NC1CC1)=O)CC1=CC=CC=C1)=O)OCC1CC1
|
|
| MCULE-7668094759 |
0.69 |
CC(C(N[C@@H](CC1=CC=C(O)C=C1)CO)=O)N1C(C)CCC1C
|
|
| MCULE-3088103953 |
0.69 |
[C@H]1(CN(C[C@H]1C1C=CC=CC=1C)CC(=O)N1CCCCC1)C(O)=O
|
|
| MCULE-1260023765 |
0.69 |
COC1CN(C(C(CC2=CC=CC=C2)N)=O)CCC1
|
|
| MCULE-2183963164 |
0.69 |
CC(CN1C(C(NCC2(C3=C(C=CC=C3)CC2)O)=O)CCC1)C
|
|
| MCULE-2040259836 |
0.69 |
CC1C=CC=CC=1CCNC(CN1C(C(=O)O)CCC1)=O
|
|
| MCULE-9194454457 |
0.69 |
[C@H]1(CN(C[C@H]1C1=CC=CC=C1)CC(=O)N1CCOCC1)C(O)=O
|
|
| MCULE-8214295444 |
0.69 |
NC([C@]1(NC(CC2=CC=C(C3CCC3)C=C2)=O)C[C@@H](O)C1)=O
|
|
| MCULE-5660387885 |
0.69 |
C1(=O)[C@H](CC(C)C)NC(COC2=CC=C(C=C2)C[C@H](NC(=O)CN1CCOC)C(=O)NC1CCOCC1)=O
|
|
| MCULE-5739271631 |
0.69 |
COCC1(C(N2CC(CC3=CC=CC=C3)NCC2)=O)CCC1
|
|
| MCULE-2268955580 |
0.69 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(CC1=CC=CN=C1)=O)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
|
|
| MCULE-2683397801 |
0.69 |
CN(CCN1C(=O)CN(C([C@]2(C3=CC=CC=C3)C[C@H](O)C2)=O)CC1)C
|
|
| MCULE-4605687111 |
0.69 |
CN1C(C(N2CC3(C4C=CC=CC=4CO3)CC2)=O)(C)CC(O)C1
|
|
| MCULE-3302454223 |
0.69 |
CC(CCC(C(=O)O)NC(CNC(CC1C=CC=CC=1)=O)=O)(C)C
|
|
| MCULE-4211552057 |
0.69 |
C1(=O)[C@H](CC(C)C)NC(COC2=CC=C(C=C2)C[C@@H](NC(=O)CN1CCOC)C(=O)NC1CCOCC1)=O
|
|
| MCULE-4085277771 |
0.69 |
OC(C1=CC=CC=C1)CC(N1CC(N2C(=O)CNCC2)CCC1)=O
|
|
| MCULE-5171946409 |
0.69 |
C1(C2C=CC=CC=2)(CC1)C(=O)N1CC(=O)N[C@H](CC(C)C)C(=O)N(C)[C@@H](C)C(N[C@@H](CC2C=CC=CC=2)C(=O)N[C@H]2CCO[C@@H]([C@H]2O)C1)=O
|
|
| MCULE-8224311065 |
0.69 |
N1(CCCCCCCC1=O)CC(=O)N1CCC(CC1)(O)C1=CC=CC=C1
|
|
| MCULE-1018943082 |
0.69 |
CC1C=CC(CCC(NCC(NC(C(=O)O)(C)C)=O)=O)=CC=1
|
|
| MCULE-9607816465 |
0.69 |
C1(CCCCC(=O)N1)(CC1C=CC=CC=1)C(NCCC1C=CC=CC=1)=O
|
|
| MCULE-5742009204 |
0.69 |
C1(CC2C(=CC=CC=2)C1)(N1CCCCC1)C(=O)NCC(COCC)O
|
|
| MCULE-3738343623 |
0.69 |
CC1C=CC=CC=1CCNC(CN1[C@H](C(=O)O)CCC1)=O
|
|
| MCULE-9286649407 |
0.69 |
CC1C=CC=C(CCC(N[C@@H](C(=O)O)CC2C=CC=CC=2)=O)C=1
|
|
| MCULE-1660711656 |
0.69 |
COCCNCCNC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O
|
|
| MCULE-4319289773 |
0.69 |
C1(CC2C(=CC=CC=2)C1)(C(=O)NC[C@@H]1CCCN1)N1C[C@@H](C)O[C@@H](C)C1
|
|
| MCULE-9388949440 |
0.69 |
O[C@H](C(N1CCN(CC(N2CCCCCC2)=O)CC1)=O)CC1=CC=CC=C1
|
|
| MCULE-6003017888 |
0.69 |
CCC(C1=CC=CC=C1)(C(N1CC(CCO)NCC1)=O)CC
|
|
| MCULE-1395969798 |
0.69 |
CO[C@@H]1CN(CC(C2=CC=CC=C2)(C)C)[C@H](C(N)=O)C1
|
|
| MCULE-8079237752 |
0.69 |
CC(N(CC(NCCCCC(=O)O)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-9338556508 |
0.69 |
CC1C=CC=CC=1CCNC(CN1[C@@H](C(=O)O)CCC1)=O
|
|
| MCULE-6180890610 |
0.69 |
CC1C=CC=C(CCC(NC(C(=O)O)CC2C=CC=CC=2)=O)C=1
|
|
| MolPort-046-697-542 |
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CC(=O)N1C[C@@H]2C[C@@H](O)CN2C2(CN(CCC3=CC=CC=C3)C2)C1
|
|
| MolPort-028-724-874 |
0.69 |
OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)CC[C@@H]1CCCN2CCCC[C@H]12
|
|
| MolPort-027-601-822 |
0.69 |
CC(C)NC(=O)C(=O)NCC(O)(C1CC1)C1=CC=CC=C1
|
|
| MolPort-046-697-517 |
0.69 |
CC(C)C(=O)N1CC2(C1)CN(CCC1=CC=CC=C1)C[C@@H]1C[C@@H](O)CN21
|
|
| MolPort-019-678-702 |
0.69 |
O=C(NC1CC1)C(CC1=CC=CC=C1)NC(=O)C1CC2CCC1C2
|
|
| MolPort-028-734-981 |
0.69 |
FC1(F)CCN(CC1)C(=O)CN1CC(CC1=O)C1=CC=CC=C1
|
|
| MolPort-046-568-359 |
0.69 |
CC(C)[C@@H]1NC(=O)[C@@H](C)N(CCCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)CN(C)C1=O)C(=O)CN1CCCCC1
|
|
| MolPort-046-741-801 |
0.69 |
O=C(CCCN1CCCCCC1)N1C[C@H](CC2=CC=CC=C2)NC(=O)C1
|
|
| MolPort-027-832-623 |
0.69 |
CN(C)C(=O)CN1C[C@H]([C@@H](C1)C1=CC=CC=C1)C(O)=O
|
|
| MolPort-045-963-853 |
0.69 |
CCC12CC3CC(O)(C1)CC(C3)(C2)C(=O)N1CCN(CCC2=CC=CC=C2)C(=O)C1
|
|
| MolPort-010-745-662 |
0.69 |
CC(C)OCCCNC(=O)C1(C)CCC(=O)N1CCC1=CC=C(C)C=C1
|
|
| MolPort-045-984-545 |
0.69 |
OC[C@H](CC1=CC=CC=C1)NC(=O)C1(CCC1)N1CCOCC1
|
|
| MolPort-007-892-294 |
0.69 |
CCOCCCNC(=O)C1(C)CCC(=O)N1CCC1=CC=C(C)C=C1
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|
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Cl.OC(=O)C1CC2CCCCC2N1CC(=O)NCCC1=CC=CC=C1
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CC(C)C[C@@H]1NC(=O)[C@@H]2CCC[C@H]2NC(=O)[C@H](C)NC(=O)C2C[C@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)C1=CC=CC=C1
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OCCCNC(=O)C1(CC2=CC=CC=C2C1)N1CCCCC1
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CC(C)C[C@H](NC(C)=O)C(=O)N1CCCC1CC(O)C1=CC=CC=C1
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COC(=O)C(CC(C)C)NC(=O)CNC(=O)CNC(=O)CCC1=CC=CC=C1
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CC(C)[C@H]1NC(=O)[C@@H](C)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)CCCN(CCCNC1=O)C(=O)C1CCC1
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CC(=O)N1CCCC1C(=O)NCC(O)C1=CC=CC=C1Cl
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CCC1CN(CC(C)O1)C(=O)C1CCCN1C(=O)CC1=CC=CC=C1
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CC(=O)N1CCCC1C(=O)NCC(O)C1=CC=CC(=C1)C(F)(F)F
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COCCOCCC(=O)NC(CC1=CC=CC=C1)C(=O)N1CCCC1
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CCN1C(CC2(CCN(CCCC3=CC=CC=C3)CC2)C1=O)C(=O)NCCOC
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[2H]C1=C([2H])C([2H])=C(C[C@H](NC(=O)[C@@H](N)CC(O)=O)C(=O)OC)C([2H])=C1[2H]
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COC(=O)C(CC1=CC=CC=C1)NC(=O)C(N)CC(O)=O
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OC1(CCN(CC1)C(=O)CCCC(=O)N1CCNC(=O)C1)C1=CC=C(Cl)C=C1
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0.68 |
[2H]C([2H])([2H])OC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](N)CC(O)=O
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0.68 |
COCCC(=O)N1CCCNC(=O)[C@H](NC(=O)[C@@H](C)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)CCC1)C(C)C
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| MolPort-046-103-829 |
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CCCC(=O)N1CCCCC1C(=O)N1CCC(CO)(CC2=CC=C(F)C=C2)C1
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Cl.CC(C)C[C@H](NC(=O)C[C@@H](CNC(=O)[C@H](C)N)C1=CC=C(Cl)C=C1)C(O)=O
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CCN1CCN(CC1)C1(CC2=CC=CC=C2C1)C(=O)N(C)CC(O)C1=CC=CC=C1
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CCCOCC(=O)NC(CC1=CC=CC=C1)C(=O)N1CCN(C)CC1
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| MolPort-046-041-647 |
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COCCN1CCN2[C@@H](CN(CC3CC3)[C@@H](CC3=CC=CC=C3)C2=O)C1=O
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|
| MolPort-046-187-441 |
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CC1=C(C=CC=C1)C1(O)CCN(CC(=O)NCC2CCCCC2)C1
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| MolPort-028-912-494 |
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CCCC(=O)C(CCC1=CC=CC=C1)NC(C)C(=O)N1[C@H]2CCC[C@H]2C[C@H]1C(O)=O
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| MolPort-001-792-024 |
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COC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@@H](N)CC(O)=O
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| MolPort-005-048-332 |
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CCN1CCN(CC1)C1(CC2=CC=CC=C2C1)C(=O)N1CCC(CC1)OC
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CC(C)(C)C(=O)NCC(=O)N1CC(C2COCCC12)C1=CC=CC=C1
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CC(C)(N1CCOCC1)C(=O)N1CCC(O)(C1)C1=CC=C(F)C=C1
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FC1(F)CCC(C1)C(=O)NC(CC1=CC=CC=C1)C(=O)N1CCOCC1
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O=C(NC(CC1=CC=CC=C1)C(=O)N1CCC2(CC1)OCCO2)C1CCCCC1
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|
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0.68 |
CO[C@H]1C[C@H](N(C)C1)C(=O)NCCC1=CC=CC(=C1)C#N
|
|
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0.68 |
COC(C)(C)C(=O)N1CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](CC2=CNC3=CC=CC=C23)NC(=O)C1
|
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| MolPort-027-901-135 |
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CC(CC(=O)N(CC1CCCO1)CC(=O)N1CCCC1)C1=CC=C(F)C=C1
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|
| MolPort-005-106-214 |
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COC(=O)[C@@H]1C[C@@H](CN1C(C)C)NC(=O)CCC1=CC=C(C)C=C1
|
|
| MolPort-027-809-717 |
0.68 |
CCN1CCN(CC(=O)N2C[C@H]([C@@H](C2)C2=C(C)C=CC=C2)C(O)=O)CC1
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0.68 |
CC[C@H](C)[C@@H]1NC(=O)CN(CC2=CC=C3OCCOC3=C2)CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C1=O
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| MolPort-045-917-225 |
0.68 |
COCC(=O)N1CCNC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](CC2=CNC3=CC=CC=C23)NC(=O)C1
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| MolPort-045-944-935 |
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O[C@@H]1C[C@@H]2N(C1)C(=O)[C@@H](CC1=CNC3=CC=CC=C13)NC(=O)CN(CCNC(=O)[C@H](CC1=CC=CC=C1)NC2=O)C(=O)[C@@H]1CCCNC1
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| MolPort-046-567-991 |
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CCOCCC(=O)N1C[C@@H](NC(=O)[C@@H](C)NC(=O)[C@H](CC2=CC=C(OC)C=C2)NC(=O)[C@H](CC(C)C)NC(=O)C1)C(C)C
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| MolPort-044-612-496 |
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[Na+].COC1=CC=C(C=C1)C1(CNC(=O)C2CCC(N2C2CC2)C([O-])=O)CC1
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| MolPort-042-588-403 |
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ClC1=CC=C(C=C1)[C@@H]1C[C@H]1NC(=O)C1CCCN1C1CCOCC1
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|
| MolPort-046-754-162 |
0.68 |
CC[C@@H]1NC(=O)[C@H](CC2=CC=C(OC[C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)[C@@H]3C[C@@H](O)CN3C1=O)C=C2)NC(=O)C1=CC=CC=C1
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CO[C@H]1C[C@H](N(C)C1)C(=O)N1CCC(O)(CC2=CC=CC(C)=C2)CC1
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CO[C@@H]1CN[C@H](C1)C(=O)NCC1(CCOCC1)C1=CC=C(Cl)C=C1
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COC(=O)CC1N(CCNC1=O)C(=O)CCC1(CC2=CC3=CC=CC=C3C=C2)CCC(=O)N1
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NC(CC1=CC=CC=C1)C(=O)NCC(O)=O
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CC(O)C1CCN(CC1)C(=O)C(N)CC1=CC=CC=C1
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OCCN(CC(=O)NCC1(CCC1)C1=CC=CC=C1)C1CC1
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CC(=O)N1CCCC1C(=O)NCC1(CCCCC1)C1=CC=CC=C1
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CC(CC1=CC=C(Br)C=C1)NC(=O)C1CCCN1C(C)=O
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FC1=CC=C(C=C1)C1(CNC(=O)C2CCCN2C(=O)C2CC2)CC1
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C[C@H]1N(C[C@H]2CCCN2C1=O)C(=O)CCC1=CC(O)=CC=C1
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CC(C)(C)C(=O)N1CC[C@H]2CC(=O)N(CC[C@H]2C1)[C@@H](CC1=CC=CC=C1)C(N)=O
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COC1=CC=C(CCC(=O)N2C[C@H](C[C@H]2C(=O)N2CCOCC2)OC2=CC=CC=C2)C=C1
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OC1CN([C@@H]2[C@H](NC(CC3=C4C(C=CC=C4)=CC=C3)=O)CCC2)CC1
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CC(N1CC2(CN(C(=O)CC3=CC=CC=C3)C[C@@H]3C[C@H](CN23)O)C1)C
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N1(CCNC(=O)C1CC1C=CC=CC=1)C(=O)C1CCN(CC1)C(=O)N(C)C
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CC(CC(CC(NC(C(=O)O)CC1C=CC=CC=1)=O)C)C
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C(=O)([C@H](CC1C=CC=CC=1)NC(=O)[C@H]1CC[C@@H](CC1)C(C)C)N1CCC(CC1)C(N)=O
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NC(C(NCC1(N2CCCCC2)CCOCC1)=O)CC1C=CC=CC=1
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CC(C1C=CC(CCC(N2[C@@H](C(=O)O)CCC2)=O)=CC=1)(C)C
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C(=O)([C@@H](CC1C=CC=CC=1)NC(=O)[C@H]1CC[C@@H](CC1)C(C)C)N1CCC(CC1)C(N)=O
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N1[C@@H](CC2=CC=CC=C2)C(=O)N[C@@H](CC)CN(CC2C=CC=CC=2)CC(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)C1=O
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CC1C=CC(CCC(N2[C@@H](C(=O)O)CCC2)=O)=CC=1
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CC(C1(C(=O)O)CN(C(CNC(CC2C=CC=CC=2)=O)=O)CC1)C
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N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)NCCN(CC2C=CC=CC=2)CC(=O)N[C@@H](CC(C)C)C1=O
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CC1N(C(CN(C(=O)C)CCC2C=CC=CC=2)=O)CC(C(=O)O)CC1
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CC(C(N1C(C(=O)O)(C)CCC1)=O)CC1C=CC(C)=CC=1
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|
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CCCC(C(=O)O)NCC(NCC1(C2C=CC=CC=2)CCOCC1)=O
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CCC1C=CC(CCC(N2[C@@H](C(=O)O)CCC2)=O)=CC=1
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OC(C(NC(CNC(CC1C=CC=C2C=1C=CC=C2)=O)=O)CC1CC1)=O
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|
| MCULE-2813486823 |
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CC(C(N1C(C(NC(CC2C=CC=CC=2)CCC(=O)O)=O)CCCC1)=O)C
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|
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CC(C(=O)O)N(C(CC(C1C=CC=CC=1)C1C=CC=CC=1)=O)CCNC(=O)C
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|
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0.68 |
[C@@H]1(CN(C[C@@H]1C1=CC=CC=C1)CCO)NC(=O)C1CCN(CC1)C(C)=O
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|
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CC(NC(C(NCC(C(=O)O)CC1C=CC=C(C)C=1)=O)C1CCCC1)=O
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|
| MCULE-8123785623 |
0.68 |
CC1=CC=C(CCC(N2[C@@H](C(O)=O)CCC2)=O)C=C1
|
|
| MCULE-7983458361 |
0.68 |
C(=O)(C(CC1C=CC=CC=1)NC(=O)C1CCC(CC1)C(C)C)N1CCC(CC1)C(N)=O
|
|
| MCULE-1081747758 |
0.68 |
N1(C[C@@H](C[C@H]1C(NCC)=O)N)C(CCC1=CC=C(C(C)=C1)C)=O
|
|
| MCULE-8680239164 |
0.68 |
CC(C(N1CCCCC1)=O)NC(CN1C[C@@H](C2C=CC=CC=2)[C@H](N)C1)=O
|
|
| MCULE-1881844910 |
0.68 |
C1(C2C=CC=CC=2)(CC1)C(=O)N1C[C@@H]([C@@H](N2CCN(CC2)C)C1)O
|
|
| MCULE-7969035683 |
0.68 |
CC1C=CC=C(CC(C(=O)O)CNC(CNC(CCC2CCCC2)=O)=O)C=1
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|
| MCULE-4772124745 |
0.68 |
OC(C1OCCC1)CNC(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O
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|
| MCULE-2698742300 |
0.68 |
CC(C(C(NC(CC1C=CC=CC=1)CCC(=O)O)=O)N1C(=O)CCC1)C
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|
| MCULE-8182784837 |
0.68 |
CCCC(N1C(C(NC(CC2C=CC=CC=2)CCC(=O)O)=O)CCCC1)=O
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|
| MCULE-3287198147 |
0.68 |
C(=O)(C(CC(C)C)NC(=O)C(CC1C=CC=CC=1)NC(CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(C=C1)O)=O)NC(CCC(C)NC(N)=N)C(O)=O.Cl.Cl
|
|
| MCULE-8924260243 |
0.68 |
CCC(C(NC(CC1C=CC=CC=1)CCC(=O)O)=O)N1C(=O)CCC1
|
|
| MCULE-9806683335 |
0.68 |
COC(C(NC(C(CC1CCCCC1)N)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-6409157721 |
0.68 |
CO[C@@H]1CN(C(CCC2=CC3=C(NC=C3)C=C2)=O)[C@H](C(N)=O)C1
|
|
| MCULE-2550592698 |
0.68 |
C1(N(C)CCC2=CC=CC=C2)(CC2C(=CC=CC=2)C1)C(=O)NCC(C)O
|
|
| MCULE-6582457944 |
0.68 |
CC(NC(CN1[C@@H](C(=O)O)CCC1)=O)CC1C(F)=CC=CC=1F
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|
| MCULE-7141134020 |
0.68 |
C1(C2C=CC=CC=2)(CC(=O)N2CCN(C(=O)C2)CC2=CC=CC(C)=C2)CC(N(CCCOC)C1=O)=O
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|
| MCULE-8828000325 |
0.68 |
OC(C1(NC(CNC(CC2C=CC=C3C=2C=CC=C3)=O)=O)CCCC1)=O
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|
| MCULE-3640312942 |
0.68 |
O=C(NC(CC1=CC=CC=C1)CN1CCOCC1)CC1C(=O)NC(=O)C1
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|
| MCULE-9499975421 |
0.68 |
N12CCC[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@H](C(C)C)C2=O)C(=O)N1CCCCCC1
|
|
| MCULE-7516098900 |
0.68 |
CC(C(N1CCOCC1)=O)NC(C(N(C)C)CC1=CC=CC=C1)=O
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|
| MCULE-2287088012 |
0.68 |
CCCCC1C=CC(CC(N(CC(N2CC(C(=O)O)CCC2)=O)C)=O)=CC=1
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|
| MCULE-3655149685 |
0.68 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(N2C3CC(NCC2CC3)=O)=O)C1
|
|
| MCULE-9893591158 |
0.68 |
NC(C(NC([C@H]1C[C@@H](C(=O)O)CC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-3257951965 |
0.68 |
CCCC(N1C(C(NCC(C2C=CC=CC=2)(C(=O)O)CC)=O)CCCC1)=O
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|
| MCULE-4190388904 |
0.68 |
CC1C(C)C(NC(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)C(C)O1
|
|
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0.68 |
C1(N(C)CCC2=CC=CC=C2)(CC2C(=CC=CC=2)C1)C(=O)NC(C)CO
|
|
| MCULE-1812122602 |
0.68 |
COCCN1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)CC1
|
|
| MCULE-6580424479 |
0.68 |
[C@H](NC(=O)[C@H](CC(=O)O)NC(=O)CCC(=O)O)(CC1C=CC=CC=1)C(=O)N(C)[C@H](C(=O)NCC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N)CCSC)CC1C=CC=CC=1
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|
| MCULE-9863014423 |
0.68 |
CC1N(C(CNC(CC2C=CC=CC=2)=O)=O)CCC1C(=O)O
|
|
| MCULE-7557950587 |
0.68 |
CCC(C1C=CC=CC=1)(C(=O)O)CNC(CN1C(=O)CCCCCC1)=O
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|
| MCULE-8371662705 |
0.68 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@@H](C(C)C)C2=O)C(=O)N1CCCCCC1
|
|
| MCULE-1251582254 |
0.68 |
COCC1(C(NC(C(=O)O)CC2C=CC=CC=2)=O)CCC1
|
|
| MCULE-2620153567 |
0.68 |
CCC(C1C=CC=CC=1)(C(=O)O)CNC(CN1C(=O)CCCCC1)=O
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|
| MCULE-8655628063 |
0.68 |
C1(O)(CC2C=CC=CC=2)C(=O)NC(OC)(CC(C)C)C(=O)N1
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|
| MCULE-7358557960 |
0.68 |
N12C[C@H](C[C@H]1CN([C@@H](CC1=CC=CC=C1)C2=O)C(=O)CCN1C=NN=N1)OC
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| MCULE-4697047953 |
0.68 |
CC1(C(=O)O)N(C(CNC(CC2C=CC=C(F)C=2)=O)=O)CCC1
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|
| MCULE-8621969108 |
0.68 |
CN(C1=CC=CC=C1)CCNC(C1N(C(CC2=C(F)C=CC=C2)=O)CC(O)C1)=O
|
|
| MCULE-6513920620 |
0.68 |
CN1C(=O)CC[C@@H]1C(NCC(C1=CC=C(O)C=C1)O)=O
|
|
| MCULE-2250264069 |
0.68 |
COC1CN(C(CCC2C=C(C)C=C(C)C=2)=O)C(C(=O)O)C1
|
|
| MCULE-4787645170 |
0.68 |
CCCC(C(NC(C(C(=O)O)C)C)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-9161755239 |
0.68 |
N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1C=CC(=CC=1)OC)C(CCC1C=CC(=CC=1)OC)=O
|
|
| MCULE-3219098267 |
0.68 |
COC1CN(C(CCC2C=CC=C(C)C=2)=O)C(C(=O)O)C1
|
|
| MCULE-6211115508 |
0.68 |
O=C(N1CCCCC1)CN1C(=O)C(C2=CC=CC=C2)CC1=O
|
|
| MCULE-2012308905 |
0.68 |
CC(C1=CC=CC=C1)CC(N1C(C(N2CCOCC2)=O)CCCC1)=O
|
|
| MCULE-4750712800 |
0.68 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(CC1C=CC(=CC=1)C1C=CC=CC=1)=O)C
|
|
| MCULE-7190191610 |
0.68 |
O=C([C@@H](N)C(C)C)N[C@H](C(=O)O)CC1C=CC(O)=CC=1
|
|
| MCULE-5922808204 |
0.68 |
CN(C(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O)CC(N1CCOCC1)=O
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|
| MCULE-5061742801 |
0.68 |
COC1CN(C(CCC2C=CC3C=CC=CC=3C=2)=O)C(C(=O)O)C1
|
|
| MCULE-8485702795 |
0.68 |
CC(C(N[C@H](C(N[C@@H]1C[C@@H](C2=C(C)C=CC=C2)C1)=O)CO)=O)C
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|
| MCULE-7248846490 |
0.68 |
CNC(CC1(CN(CC(NCCC2=C(C)C=CC=C2)=O)CCC1)O)=O
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|
| MCULE-2512027708 |
0.68 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(=O)[C@@H]1CCCN2CCCC[C@]12[H])C
|
|
| MCULE-1095796761 |
0.68 |
CC1=C(CC(N2[C@@H](CO)CN3[C@@H](CCC3)C2)=O)C=CC=C1
|
|
| MCULE-9838188843 |
0.68 |
N1[C@@H](CC2C=CC(=CC=2)OC)C(=O)N[C@H](C)C(=O)N[C@H](CNCC(=O)N[C@@H](CC(C)C)C1=O)C(C)C
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|
| MCULE-9531828095 |
0.68 |
C(=O)(C1(CCCCC1)N)N[C@]([H])(CC1=CC=CC=C1)C(OC)=O
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|
| MCULE-4098754497 |
0.68 |
O=C(C(C1=CC=CC=C1)C1=CC=CC=C1)NC(C(N1CCCCC1)=O)CC1=CC=CC=C1
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|
| MCULE-7886727989 |
0.68 |
N12CCC[C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CN(C(=O)CC1C=CC(=CC=1)C1C=CC=CC=1)CC(=O)N[C@@H](C)C2=O)CC1C=CC=CC=1
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|
| MCULE-3028624341 |
0.68 |
N1(C[C@H](CC2C=CC=CC=2)NC(=O)C1)C(COCCCC)=O
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|
| MCULE-4379459762 |
0.68 |
N1(C[C@H]([C@H](C(O)=O)C1)C1C=CC=CC=1)C(=O)C(C)(C)N
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|
| MCULE-3210476043 |
0.68 |
O=C(N1C(C(N2CCOCC2)=O)CCCC1)CCC1=CC=CC=C1
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|
| MCULE-7373415843 |
0.68 |
OC(C1N(C(CNC(CC2C=CC=C(F)C=2)=O)=O)CCC1)=O
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|
| MCULE-6325814731 |
0.68 |
CN1C(=O)CC(C(NC(C(O)=O)CC2=CC=CC=C2)=O)CC1
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|
| MCULE-9988681437 |
0.68 |
N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1C=CC(=CC=1)OC)C(=O)CN(C)C
|
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| MCULE-8581814283 |
0.68 |
CC(N1[C@H](C(NCC(C2=CC(Cl)=CC(Cl)=C2)O)=O)CCC1)=O
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|
| MCULE-3649096620 |
0.68 |
NC(C(NC(C1CCC(C(=O)O)CC1)=O)CC1C=CC=CC=1)=O
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|
| MCULE-2400753318 |
0.68 |
N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1C=CC(=CC=1)OC)C(C)=O
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|
| MCULE-5119178051 |
0.68 |
OC1C(=O)N(CC(N(C2CC2)CCC2=CC(F)=CC=C2)=O)CCCC1
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|
| MCULE-3189904984 |
0.68 |
C1(CCCCC1)(N1CCCC1)C(=O)NCC(O)CC1=CC=CC=C1
|
|
| MCULE-1103123914 |
0.68 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)NCCN(C(=O)[C@@H](N)CC2=CC=C(C=C2)OC)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-5431184199 |
0.68 |
CCC(C1C=CC=CC=1)(C(=O)O)CNC(C(NC(C1CCCC1)=O)C)=O
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|
| MCULE-9108215546 |
0.68 |
C(O)(=O)[C@H](CC1C=CC(O)=CC=1)NC(=O)[C@H](C(C)(C)C)N
|
|
| MCULE-9035520048 |
0.68 |
OC(C1N(CC(NCC2(C3C=CC=CC=3)CCCCC2)=O)CCCC1)=O
|
|
| MCULE-9042718843 |
0.68 |
OC1C(=O)N(CC(NCC2(CC2)CC2=CC=C(F)C=C2)=O)CCCC1
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|
| MCULE-5683621941 |
0.68 |
CC(C(C(NC(C(O)=O)CC1=CC=C(O)C=C1)=O)N)C
|
|
| MCULE-9966245605 |
0.68 |
CC(N1C(=O)C(NC2(CC3=C(C=CC=C3)C2)CO)CCC1)C
|
|
| MCULE-2561941363 |
0.68 |
OC([C@H]1N(C(CNC(CC2C=CC=C(F)C=2)=O)=O)CCC1)=O
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|
| MCULE-2594950735 |
0.68 |
CN(C(C1N(C2CCOCC2)CCC1)=O)CCCC1=CC=CC=C1
|
|
| MCULE-5806173116 |
0.68 |
N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1C=CC(=CC=1)OC)C(CN)=O
|
|
| MCULE-6126384013 |
0.68 |
CC(N1[C@@H](C(N2CC3(CCCCC3)N(CC3=CC=CC=C3)CC2)=O)C[C@@H](O)C1)=O
|
|
| MCULE-9247730614 |
0.68 |
CC1C=CC=CC=1C(CNC(C1NCCC1)=O)O
|
|
| MCULE-9809169702 |
0.68 |
N1(CC(NCCC(OCC)=O)=O)CC(CC1=O)C1C=CC=CC=1
|
|
| MCULE-8699478159 |
0.68 |
OC([C@@H]1N(C(CNC(CC2C=CC=C(F)C=2)=O)=O)CCC1)=O
|
|
| MCULE-6042788160 |
0.68 |
CC(CN1C(C(NCC(C2=C(C)C=CC=C2)O)=O)CCC1)C
|
|
| MCULE-9558047571 |
0.68 |
N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1=CC=C(C=C1)OC)C(C(C)C)=O
|
|
| MCULE-3757289186 |
0.68 |
CC(C[C@@H](C(=O)O)NC(CNC(C1(C2C=CC=C(C)C=2)CCCC1)=O)=O)C
|
|
| MCULE-1830872018 |
0.68 |
N1(CC(CC1=O)C1=CC=CC=C1)CC(=O)N1CCC(CC1)C#N
|
|
| MCULE-6690711635 |
0.68 |
OC1CC(C(N2CCC(OCCC3C=CC=CC=3)CC2)=O)NC1
|
|
| MCULE-6079292477 |
0.68 |
COC(C(NC(C1(CCCCC1)N)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-1189285140 |
0.68 |
CCCC(C(NC(CC(=O)O)C)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-8443370625 |
0.68 |
NCCCC[C@](NC([C@](CC(O)=O)(NC([C@](CC(N)=O)(NC([C@@]1(CCCN1C([C@](CC(N)=O)(NC([C@](CCCNC(N)=N)(NC([C@](CC(C)C)(NC([C@](CC(C)C)(NC([C@](CC1=CC=CC=C1)(NC([C@@](N)(CO)[H])=O)[H])=O)[H])=O)[H])=O)[H])=O)[H])=O)[H])=O)[H])=O)[H])=O)(C(N[C@@](CC1=CC=C(O)C=C1)(C(N[C@@](CCC(O)=O)(C(N1CCC[C@]1(C(N[C@@](CC1=CC=CC=C1)(C(O)=O)[H])=O)[H])=O)[H])=O)[H])=O)[H]
|
|
| MCULE-6536870553 |
0.68 |
O=C(C12CCCN(C1)CC2)NC(C(N1CCCC1)=O)CC1=CC=CC=C1
|
|
| MCULE-9281160467 |
0.68 |
N1(C[C@H](CC2=CC=CC=C2)NC(=O)C1)C(=O)CCC1=CC=C(C=C1C)C
|
|
| MCULE-3857406352 |
0.68 |
[H]C(O)(CO)C(O)(C(O)([H])C(O)(C(NC(CC1C=CC=CC=1)C([O-])=O)=O)[H])[H]
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|
| MCULE-8897589295 |
0.68 |
C(=O)(C(N)CC1C=CC(=CC=1)O)NC(C)C(=O)NCC(=O)NC(CC(C)C)C(=O)NCC(OCC)=O.Cl
|
|
| MCULE-2064995810 |
0.68 |
CCCC(C(N1C[C@@H](C2C=CC=CC=2)[C@H](N)C1)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-6065554438 |
0.68 |
OC(C1N(CC(NCC2(C3C=CC(F)=CC=3)CCCC2)=O)CCC1)=O
|
|
| MCULE-9893342601 |
0.68 |
N12CC[C@H](C[C@@]1([H])C(N(CCC1=CC=CC(OC)=C1)CC2=O)=O)O
|
|
| MCULE-2544563359 |
0.68 |
CCCN(CC(N1CCC(NC(CCC2C=CC=CC=2)=O)CC1)=O)CC(=O)O
|
|
| MCULE-9960395912 |
0.68 |
[C@@H]1(C(O)=O)CN(C[C@H]1C1C=CC=CC=1C)C(=O)CN1CCCC1
|
|
| MCULE-9130750603 |
0.68 |
C1(CC2C(=CC=CC=2)C1)(C(=O)NCC(C)(C)CO)N1C[C@@H](C)O[C@@H](C)C1
|
|
| MCULE-1166357643 |
0.68 |
N1(C[C@H](CC2C=CC=CC=2)NC(=O)C1)C(=O)CCC(=O)N(C)C1CCCCC1
|
|
| MCULE-2569368843 |
0.68 |
OC([C@@H]1N(CC(NCC2(C3=CC=C(F)C=C3)CCCC2)=O)CCC1)=O
|
|
| MCULE-7929322349 |
0.68 |
[C@H](C(=O)N[C@H](C(=O)N)CCCCN)(NC(=O)[C@H](C(C)C)NC(=O)[C@H]([C@@H](C)CC)NC(=O)[C@H](CCC(=O)N)NC(=O)[C@H](C(C)C)NC(=O)C)CC1C=CC(O)=CC=1.OC(=O)C(F)(F)F
|
|
| MCULE-8278750850 |
0.68 |
OC[C@@H]1N(C([C@H](C2=CC=CC=C2)O)=O)C[C@H]2N(CCC2)C1
|
|
| MCULE-3907179041 |
0.68 |
CCCN(C(C(NC(C1C=CC=CC=1)=O)CC1C=CC=CC=1)=O)CC(=O)O
|
|
| MCULE-3413564802 |
0.68 |
Cl.CO[C@H]1C[C@@H](C(NCCC2=C(F)C=CC=C2F)=O)NC1
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|
| MCULE-2926350516 |
0.68 |
C12(CC1)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N[C@@H](CC(C)C)COC1C=CC(=CC=1)C[C@@H](C(=O)N[C@H](C)C(=O)N2)NC(=O)[C@@H]1CCC(=O)N1
|
|
| MCULE-3430822121 |
0.68 |
[H]C(O)(CO)C(O)(C(O)([H])C(O)(C(NC(CC1C=CC=CC=1)C([O-])=O)=O)[H])[H].[Na+]
|
|
| MCULE-1434766263 |
0.68 |
[Cl-].C(=O)(C(CC1=CC=C(O)C=C1)[NH3+])N[C@@]([H])(C)C(=O)NCC(=O)NC(CC(C)C)C(=O)NCC(OCC)=O
|
|
| MCULE-8735132367 |
0.68 |
C1(=O)[C@H](CC(C)C)NC(COC2C=CC(=CC=2)C[C@@H](NC(=O)CN1CCOC)C(=O)N[C@H]1CC[C@@H](CC1)O)=O
|
|
| MCULE-2540569431 |
0.68 |
OC([C@H](NC(CNC(NC1CCCCC1)=O)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-2394541342 |
0.68 |
CN1C(C(NCC(C2=CC=C(F)C=C2)(F)F)=O)(C)CC(O)C1
|
|
| MCULE-3656729580 |
0.68 |
O[C@@H]1[C@H](C[C@@](C[C@H]1O)(O)C(N[C@H](C(N)=O)CC1=CC=C(OC)C=C1)=O)NC(=O)CC(C)(C)C
|
|
| MCULE-6526163996 |
0.68 |
CCC1(C(=O)N(CC(N[C@@H](C(=O)O)CC2C=CC=CC=2)=O)C(=O)N1)CC
|
|
| MCULE-7631570134 |
0.68 |
COC1=C(O)C=CC(CCNC(C2(N(C)CC(O)C2)C)=O)=C1
|
|
| MCULE-2740497305 |
0.68 |
C12(CC1)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N[C@@H](CC(C)C)COC1C=CC(=CC=1)C[C@@H](C(=O)N[C@H](C)C(=O)N2)NC(=O)[C@H]1CCC(=O)N1
|
|
| MCULE-7628414352 |
0.68 |
N1[C@@H](C(C)C)C(=O)N(C)CC(=O)N[C@@H](CC2C=CC=CC=2)C(NCCCN(C(=O)COC(C)C)[C@H](C)C1=O)=O
|
|
| MCULE-2377097172 |
0.68 |
CC(NC(N1[C@H](C(NCC(C(=O)O)CC2C=CC=C(C)C=2)=O)CCC1)=O)C
|
|
| MCULE-9267187098 |
0.68 |
C1(=O)[C@H](CC(C)C)NC(COC2C=CC(=CC=2)C[C@H](NC(=O)CN1CCOC)C(=O)N[C@H]1CC[C@@H](CC1)O)=O
|
|
| MCULE-6618843905 |
0.68 |
OC([C@@H]1N(CC(NCC2(C3C=CC(F)=CC=3)CCCC2)=O)CCC1)=O
|
|
| MCULE-5184874104 |
0.68 |
C1(C2=CC=C(C=C2)F)(CC1)C(=O)N1CCC[C@H]1C(=O)N1CCOCC1
|
|
| MCULE-6841312385 |
0.68 |
OC(C(CC1C=CC=CC=1)CNC(CNC(CC1CCCCC1)=O)=O)=O
|
|
| MCULE-3456707190 |
0.68 |
C1C([C@@H](C(N2[C@H](C(C[C@H](C(=O)NCCCCCCNC(=O)[C@@H](NC([C@@H]3CCCN3C(=O)[C@H](C3CCCCC3)NC([C@@H](NC)C)=O)=O)C(C3=CC=CC=C3)C3C=CC=CC=3)C(C3=CC=CC=C3)C3=CC=CC=C3)=O)CCC2)=O)NC(=O)[C@@H](NC)C)CCCC1
|
|
| MCULE-8157295480 |
0.68 |
OC1CC(C(NCCC2=CC=C(OC(F)(F)F)C=C2)=O)NC1
|
|
| MCULE-3629626208 |
0.68 |
O=C(N1CCC2=C(C=CC=C2)CCC1)C1NC(=O)CC1
|
|
| MCULE-4601788389 |
0.68 |
OC(CC1=CC2=C(C=CC=C2)C=C1)CN1C(=O)N2C(CCC2)C1=O
|
|
| MCULE-9749659226 |
0.68 |
OC(C(C(F)(F)F)(C1=CC=CC=C1)O)C(N1C[C@H]2N(C[C@@H](C2)O)CC1)=O
|
|
| MCULE-4298488274 |
0.68 |
C1(C(NCCCO)=O)(CC2C(=CC=CC=2)C1)N1CCCCC1
|
|
| MCULE-3140415733 |
0.68 |
OC([C@H]1N(CC(NCC2(C3C=CC(F)=CC=3)CCCC2)=O)CCC1)=O
|
|
| MCULE-9700443428 |
0.68 |
[C@H]1(CN(C[C@H]1C1C=CC=CC=1C)CC(=O)N(C)C1CCCCC1)C(O)=O
|
|
| MCULE-4559628246 |
0.68 |
OC([C@@H]1N(C(CNC(CC2C=CC=C3C=2C=CC=C3)=O)=O)CCCC1)=O
|
|
| MCULE-3784776113 |
0.68 |
CN(C(CNC(NC1CCCCC1)=O)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-4825736379 |
0.68 |
CC1NC(=O)CN(C(C(C(C(F)(F)F)(C2=CC=CC=C2)O)O)=O)C1
|
|
| MCULE-9123359053 |
0.68 |
OC(C1N(C(CNC(CC2C=CC=C3C=2C=CC=C3)=O)=O)CCCC1)=O
|
|
| MCULE-5145345582 |
0.68 |
OC(C1=CC=CC=C1)(C1=CC=CC=C1)[C@@H]1N(C(CN2CC(=O)NCC2)=O)CCC1
|
|
| MCULE-5448748573 |
0.68 |
N1(C)C[C@@H](C[C@H]1C(O)=O)NC(CCC1C=CC=CC=1Cl)=O
|
|
| MCULE-9051068078 |
0.68 |
CC(C[C@@H](C(N1C(CC(C2=CC=CC=C2)O)CCC1)=O)NC(C)=O)C
|
|
| MCULE-6470369297 |
0.68 |
C1C=C(C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N[C@@H](CC2C=CC=CC=2)CO)C=CC=1
|
|
| MCULE-9118367834 |
0.68 |
N1(C)C[C@H](C[C@H]1C(O)=O)NC(=O)C1(CCCCC1)C1C=CC=CC=1
|
|
| MCULE-7854006837 |
0.68 |
C(CC(C)C)(NC(CNC(CNC(CCC1=CC=CC=C1)=O)=O)=O)C(OC)=O
|
|
| MCULE-7359343365 |
0.68 |
C(=O)(C(CC1=CC=C(O)C=C1)[NH3+])N[C@@]([H])(C)C(=O)NCC(=O)NC(CC1C=CC=CC=1)C(OC)=O
|
|
| MCULE-7342622409 |
0.68 |
CC(CC(C(=O)O)CNC(C(NC(C1C=CC=CC=1)=O)CC1C=CC=CC=1)=O)C
|
|
| MCULE-8146893252 |
0.68 |
N1(CC(CC1=O)C1C=CC=CC=1)C(=O)CN1CCOCC1
|
|
| MCULE-4471792144 |
0.68 |
C(=O)(NC(CC1C=CC(=CC=1)F)C(O)=O)C1CCCN(CC(N)=O)C1
|
|
| MCULE-6898365515 |
0.68 |
[C@@H]1(C(O)=O)CN(C[C@H]1C1=CC=CC(F)=C1)C(=O)CN(C)C1CCN(CC1)C
|
|
| MCULE-6001016995 |
0.68 |
OC(C(CC1C=CC=CC=1)CNC(CNC(CCC1CCCC1)=O)=O)=O
|
|
| MCULE-9147327762 |
0.68 |
CC(C(NCC1OCCC1)=O)N1C[C@@H](C2C=CC=CC=2)[C@H](N)C1
|
|
| MCULE-3728443928 |
0.68 |
N1(C)C[C@H](C[C@H]1C(O)=O)NC(CCC1C=CC=CC=1Cl)=O
|
|
| MCULE-6563967975 |
0.68 |
CC(N1CC(C(N2CCN(CCC3=CC=CC=C3)CC2)=O)(O)CCC1)=O
|
|
| MCULE-5710664250 |
0.68 |
CC(NC(C1N2C(CCCC2)CC1)=O)(CC1=C(F)C=CC=C1)CO
|
|
| MCULE-4826479637 |
0.68 |
[C@H]1(CN(C[C@H]1C1C=CC(=CC=1)F)CC(=O)N1C[C@@H](C)O[C@@H](C)C1)C(O)=O
|
|
| MCULE-8365076055 |
0.68 |
COC(C(NC(CNC([C@H](C(C)C)N)=O)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-6378560871 |
0.68 |
CC1(C(=O)N(CCCC(N[C@@H](C(=O)O)CC2C=CC=CC=2)=O)C(=O)N1)C
|
|
| MCULE-2943090172 |
0.68 |
N1(CCN([C@@H](CC2=CC=CC=C2)C1=O)C(=O)OC(C)(C)C)[C@@H](CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-7557861527 |
0.68 |
C1(CC2C(=CC=CC=2)C1)(N1CCCCC1)C(=O)N(C)CCO
|
|
| MCULE-1455086713 |
0.68 |
CCCC1OCCN(C(C2N(C(CC3=CC=CC=C3)=O)CCC2)=O)C1
|
|
| MCULE-6449230690 |
0.68 |
CN1C(=O)CCC1C(N[C@H]1[C@H](C2=CC=CC=C2)OC1)=O
|
|
| MCULE-1773885235 |
0.68 |
C1(CC2C(=CC=CC=2)C1)(N1CCCCC1)C(=O)NCC(C)(C)CO
|
|
| MCULE-1806991151 |
0.68 |
OC(C(NC(CNC(NC1CCCCC1)=O)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-7707538561 |
0.68 |
[C@@H](C(C)C)(N(C)C)C(=O)N[C@@H](C(C)C)C(=O)N([C@@H]([C@H](CC)C)[C@H](OC)CC(N1[C@]([H])([C@H](OC)[C@@H](C)C(=O)NCCC2C=CC=CC=2)CCC1)=O)C
|
|
| MCULE-4768896365 |
0.68 |
CC(C(C(N1C(C)C(C(=O)O)CC1)=O)NC(CC1C=CC2C=CC=CC=2C=1)=O)C
|
|
| MCULE-7117801511 |
0.68 |
C(=O)([C@]([H])(N)CC1=CC=C(O)C=C1)N[C@@]([H])(C)C(=O)NCC(=O)N[C@@]([H])(CC1C=CC=CC=1)C(OC)=O
|
|
| MCULE-7119591493 |
0.68 |
N1(C[C@@H](C[C@H]1C(OC)=O)NC(CCC1=CC=C(C=C1)C)=O)C1CCN(CC1)C
|
|
| MCULE-1120076738 |
0.68 |
C1(N(C)C)(CC2C(=CC=CC=2)C1)C(=O)N1CCC[C@H]1C(N)=O
|
|
| MCULE-1856043757 |
0.68 |
CC1N(C(C2NCCOC2)=O)CC(C2=CC=CC=C2)C1
|
|
| MCULE-6276407734 |
0.68 |
C1(CC2C(=CC=CC=2)C1)(N1CCN(CC1)CC)C(=O)N[C@@H](CC(C)C)C(OC)=O
|
|
| MCULE-2980883885 |
0.68 |
CC(C[C@@H](C(=O)O)NC(CNC(C(CC1C=CC=C(Cl)C=1)C)=O)=O)C
|
|
| MCULE-3527561464 |
0.68 |
COC1C=CC(CCNC(C2NCC(O)C2)=O)=CC=1OC
|
|
| MCULE-5245228767 |
0.68 |
N1(C(=O)CNC1=O)CC(=O)N1CCC(O)(C2C=CC=CC=2C)C1
|
|
| MCULE-8926557129 |
0.68 |
CC(C[C@@H](C(=O)O)NC(CNC(C(CC1C=CC=C(Cl)C=1)(C)C)=O)=O)C
|
|
| MCULE-2136906035 |
0.68 |
CC(N(CC(NC(C(=O)O)C1COCCC1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-9367597123 |
0.68 |
COCC1(CCNCC1)CNC(C(NC(=O)C)CC1C=CC=C(OC)C=1)=O
|
|
| MCULE-8589312630 |
0.68 |
N1(C(CC2=CC=CC=C2)C(=O)N2CCCCC2)C(=O)C2C(C3CC2CC3)C1=O
|
|
| MCULE-8376805501 |
0.68 |
O=C(N1CC(OCCCC2=CC=CC=C2)CC1)C1NC(=O)CC1
|
|
| MCULE-2268785156 |
0.68 |
N1(C)C[C@H](C[C@H]1C(O)=O)NC(CCC1=CC=C(C(F)=C1)F)=O
|
|
| MCULE-9301551904 |
0.68 |
CC(C(N1C(C(NC2CC3=C(C=CC=C3)CC2)=O)CCC1)=O)C
|
|
| MCULE-9840833577 |
0.68 |
Cl.CO[C@H]1C[C@@H](C(N2CCC(C3=CC(F)=C(F)C=C3)CC2)=O)NC1
|
|
| MCULE-8880834197 |
0.68 |
[C@@H]1(C(O)=O)CN(C[C@H]1C1C=CC=CC=1C)C(=O)CN(C)C1CCN(CC1)C
|
|
| MCULE-2317065777 |
0.68 |
Cl.OC(C1N(CC(NCCC2C=CC=CC=2)=O)C2C(CCCC2)C1)=O
|
|
| MCULE-3809080575 |
0.68 |
C(=O)(N(C)CCC1C=CC(=C(OC)C=1)OC)[C@H]1C[C@H](CN1)O
|
|
| MCULE-9481342654 |
0.68 |
C[C@H]1[C@@H](C(N2C(CC3=CC=CC=C3)C(=O)NCCC2)=O)OCC1
|
|
| MCULE-8441560050 |
0.68 |
CN1C(=O)CC[C@@H]1C(N[C@H]1[C@H](C2=CC=C(C(F)(F)F)C=C2)C1)=O
|
|
| MCULE-5422722743 |
0.68 |
CO[C@@H]1CN(C(CCC2=CC=C(OC)C=C2)=O)[C@H](CN2CCCC2)C1
|
|
| MCULE-8439465409 |
0.68 |
CC(OC([C@@H](NC(C1NC(=O)CCC1)=O)CC1=CC=C(O)C=C1)=O)C
|
|
| MCULE-1632100335 |
0.68 |
C(=O)([C@H]1CC[C@@H](CC1)C(C)C)N[C@H](CC1C=CC=CC=1)C(=O)NC[C@@H]1CCCN2CCCC[C@@]21[H]
|
|
| MCULE-3523977520 |
0.68 |
C1(CC2C(=CC=CC=2)C1)(C(=O)N[C@@H](CC(C)C)C(N)=O)N1C[C@H](C)O[C@H](C)C1
|
|
| MCULE-8543891251 |
0.68 |
N1C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](C(C)C)NC(CN(C(=O)C2C=CC(=CC=2)F)CCNC(=O)[C@@H]1[C@@H](C)O)=O
|
|
| MCULE-6868236279 |
0.68 |
N1(CC(=O)N2C[C@H](CC)NC(=O)[C@H](CC3C=CC=CC=3)NC([C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C2)=O)C(=O)CN(C)C1=O
|
|
| MCULE-7680240697 |
0.68 |
CCC(N1C(C(N2CC(CC3=CC(Cl)=CC=C3)(O)CC2)=O)CCCC1)=O
|
|
| MCULE-9805180609 |
0.68 |
CC(N1[C@@H](C(NC2(C3=CC=C(F)C=C3)CCCC2)=O)C[C@@H](O)C1)=O
|
|
| MCULE-5517086838 |
0.68 |
CC(C1=CC=CC=C1)NC(CNC(C1(N(C)CC(O)C1)C)=O)(C)C
|
|
| MCULE-8744822130 |
0.68 |
CC(CC(C(NC(C(=O)O)CC1C=CC=CC=1)=O)NC(C1C=CC=CC=1C)=O)C
|
|
| MCULE-1857830599 |
0.68 |
N1(CCNC(=O)C1CC(OC)=O)C(CCC1(CCC(=O)N1)CC1=CC=C(C=C1)C)=O
|
|
| MCULE-2844820073 |
0.68 |
CC(NC(C(NCC(C(=O)O)CC1C=CC=CC=1)=O)C1CCCC1)=O
|
|
| MCULE-3212291472 |
0.68 |
CO[C@@H]1CN(C(CC2=CC(C(F)(F)F)=CC=C2)=O)[C@H](C(N)=O)C1
|
|
| MCULE-7305629442 |
0.68 |
C1(=O)[C@@H](C(C)C)NC(=O)CN(CCNC([C@@H](CC2C=CC=CC=2)NC(=O)[C@H](CO)NC(=O)[C@H](C)N1)=O)C(=O)CC1C=CC(=CC=1Cl)F
|
|
| MCULE-4328145183 |
0.68 |
OC(CCC(NC(CN1C(=O)CCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-8875110888 |
0.68 |
COCCC(C(=O)O)NC(C(C1C=CC=CC=1)N1C(=O)CCCC1)=O
|
|
| MCULE-2445029770 |
0.68 |
CC(N1[C@@H](C(NC2(C3=C(F)C=CC=C3)CC2)=O)C[C@@H](O)C1)=O
|
|
| MCULE-8363846745 |
0.68 |
N1[C@H](C(C)C)C(=O)NCCCN(CCCC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@H](C)C1=O)C(C1CCC1)=O
|
|
| MCULE-4648503257 |
0.68 |
N1(CCC[C@H]1C(O)=O)C(=O)[C@@H](C(C)C)NC(=O)C1(C2=CC=CC=C2)CCN(CC1)C(=O)OC(C)(C)C
|
|
| MCULE-4517341341 |
0.68 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)NCCN(C(=O)CN2CCOC2=O)CC(=O)N[C@@H](CC(C)C)C1=O
|
|
| MCULE-6735625432 |
0.68 |
N12C[C@@H](CC1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)=O)NC(C1=CC=CC=C1)=O
|
|
| MCULE-9604454266 |
0.68 |
C1(=O)[C@H](CC(C)C)NC(COC2C=CC(=CC=2)C[C@H](NC(=O)CN1CCOC)C(=O)N1CCN(CC1)C)=O
|
|
| MCULE-3539465130 |
0.68 |
CC(N1[C@@H](C(NC2(C3=CC(Cl)=CC=C3)CC2)=O)C[C@@H](O)C1)=O
|
|
| MCULE-7116718450 |
0.68 |
CC(N1C(C(NCC(C2=C(Cl)C=CC=C2)O)=O)CCC1)=O
|
|
| MCULE-2806630284 |
0.68 |
N1(CCN(C(=O)C1)C)C(=O)[C@@H]1CC2C=CC(=CC=2)OCC(N[C@@H](CC(C)C)C(=O)N(CCOC)CC(=O)N1)=O
|
|
| MCULE-7689005364 |
0.68 |
C(=O)(OC(C)(C)C)N1CCCC1([H])C(=O)NC([H])(CC1C=CC=CC=1)C(OC)=O
|
|
| MCULE-7493691716 |
0.68 |
C(=O)(OC)[C@@H](NC([C@H](CC(=O)O)N)=O)CC1C=CC=CC=1
|
|
| MCULE-8463649696 |
0.68 |
CC([C@@H](C(=O)NC(=O)[C@H](C(C)C)NC)N(C)[C@H]([C@@H](CC(=O)N1CCC[C@H]1[C@@H]([C@H](C(=O)N[C@@H]([C@H](C1C=CC=CC=1)O)C)C)OC)OC)[C@H](CC)C)C
|
|
| MCULE-2958922314 |
0.68 |
C(=O)(OC(C)(C)C)N1CCCC1([H])C(=O)NC([H])(CC1C=CC=CC=1)C(OC)=O
|
|
| MCULE-9308269229 |
0.68 |
N1[C@H](C(C)C)C(=O)NCCCN(CCCC(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N[C@H](C)C1=O)C(=O)CCOC
|
|
| MCULE-4116019913 |
0.68 |
C1(=O)[C@H](CC(C)C)NC(COC2C=CC(=CC=2)C[C@@H](NC(=O)CN1CCOC)C(=O)N1CCN(CC1)C(C)=O)=O
|
|
| MCULE-5412166673 |
0.68 |
CC1N(C(CNC(CCC2C=CC(C)=CC=2)=O)=O)CC(C(=O)O)CC1
|
|
| MCULE-8866453165 |
0.68 |
C1(=O)[C@H](CC(C)C)NC(COC2C=CC(=CC=2)C[C@@H](C(=O)NC[C@H](C)O)NC(=O)CN1CCOC)=O
|
|
| MCULE-6679720700 |
0.68 |
C1(CC2C(=CC=CC=2)C1)(N1CCN(CC1)CC)C(=O)N(C)CC(O)C1C=CC=CC=1
|
|
| MCULE-4637626244 |
0.68 |
C([C@H](N(C)[C@@H]([C@H](CC(=O)N1[C@@H]([C@H]([C@@H](C(=O)N[C@H]([C@@H](C2C=CC=CC=2)O)C)C)OC)CCC1)OC)[C@@H](CC)C)C(C)C)(=O)NC([C@H](NC)C(C)C)=O
|
|
| MCULE-5584741574 |
0.68 |
OC(C1=CC=CC=C1)C1N(C(CN2CC(=O)NCC2)=O)CCCC1
|
|
| MCULE-7259013247 |
0.68 |
C1(=O)[C@H](CC(C)C)NC(COC2C=CC(=CC=2)C[C@H](NC(=O)CN1CCOC)C(=O)N1CCN(CC1)CCO)=O
|
|
| MCULE-1646278554 |
0.68 |
CCC(C1C=CC=CC=1)CC(N1C(C(=O)O)CC(OC)C1)=O
|
|
| MCULE-1269187908 |
0.68 |
N1(CCC[C@H]1C(O)=O)C(=O)[C@H](CC(C)C)NC(=O)C1(C2C=CC=CC=2)CCN(CC1)C(=O)OC(C)(C)C
|
|
| MCULE-4167017682 |
0.68 |
N1([C@@]2([H])CCC[C@]2(C[C@@]1([H])C(O)=O)[H])C(=O)C([H])(C)NC([H])(CCC1=CC=CC=C1)C(CCC)=O
|
|
| MCULE-8691036522 |
0.68 |
N1(CCCC1C(O)=O)C(=O)C(CC(C)C)NC(=O)C1(C2C=CC=CC=2)CCN(CC1)C(=O)OC(C)(C)C
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|
| MCULE-6567936006 |
0.68 |
OC[C@@H]1N(C(CCC2=C(F)C=CC(F)=C2)=O)C[C@H]2N(CCC2)C1
|
|
| MCULE-4506874086 |
0.68 |
C1(=O)[C@H](CC(C)C)NC(COC2C=CC(=CC=2)C[C@H](C(=O)NC[C@H](C)O)NC(=O)CN1CCOC)=O
|
|
| MCULE-6258393931 |
0.68 |
Cl.C(=O)(C[C@@]([H])(CNC([C@H](C)N)=O)C1C=CC(=CC=1)Cl)N[C@@H](CC(C)C)C(O)=O
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|
| MCULE-9353295604 |
0.68 |
C1(=O)[C@H](CC(C)C)NC(COC2C=CC(=CC=2)C[C@@H](NC(=O)CN1CCOC)C(=O)N1CCN(CC1)C)=O
|
|
| MCULE-4864511308 |
0.68 |
CC1(CC(C(NC2CC(=O)N(C3C(C4=CC=CC=C4)C3)C2)=O)(O)C1)C
|
|
| MCULE-8889668856 |
0.68 |
N1(CCC[C@H]1C(O)=O)C(=O)[C@@H](C)NC(=O)C1(C2=CC=CC=C2)CCN(CC1)C(=O)OC(C)(C)C
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|
| MCULE-8980741121 |
0.68 |
CC(N1C(C(NCC(C2=CC(C(F)(F)F)=CC=C2)O)=O)CCC1)=O
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|
| MCULE-8876900286 |
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C1(=O)[C@H](CC(C)C)NC(COC2C=CC(=CC=2)C[C@H](NC(=O)CN1CCOC)C(=O)N1CCN(CC1)C(C)=O)=O
|
|
| MCULE-2822343712 |
0.68 |
NC(C(NC(CC1OCCC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-5215321838 |
0.68 |
C1(=O)[C@H](CC(C)C)NC(COC2=CC=C(C=C2)C[C@H](C(=O)NCC(=O)N2CCCC2)NC(=O)CN1CCOC)=O
|
|
| MCULE-8056607902 |
0.68 |
C(=O)([C@@H](N)CC(O)=O)N[C@@H](CC1C=CC=CC=1)C(OC)=O
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|
| MCULE-2758684384 |
0.68 |
CC([C@H](N(C)[C@H]([C@@H](CC(=O)N1CCC[C@H]1[C@@H]([C@H](C(=O)N[C@@H]([C@H](C1C=CC=CC=1)O)C)C)OC)OC)[C@H](CC)C)C(=O)NC(=O)[C@@H](NC)C(C)C)C
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|
| MCULE-6433523843 |
0.68 |
CN1C(C(NC2CCC(C3=CC=C(F)C=C3)CC2)=O)(C)CC(O)C1
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|
| MCULE-4624646024 |
0.68 |
C1(=O)[C@H](CC(C)C)NC(COC2C=CC(=CC=2)C[C@@H](NC(=O)CN1CCOC)C(=O)N1CCN(CC1)CCO)=O
|
|
| MCULE-4108389343 |
0.68 |
N1([C@@]2([H])CCC[C@]2(C[C@@]1([H])C(O)=O)[H])C(=O)C([H])(C)NC([H])(CCC1=CC=CC=C1)C(CCC)=O
|
|
| MCULE-9494096485 |
0.68 |
CC1=C(F)C=CC(CNC(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)=C1
|
|
| MCULE-1202244639 |
0.68 |
COCC(C(NC(C(NCCC(=O)N)=O)CC1C=CC=CC=1)=O)N
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|
| MCULE-7991664537 |
0.68 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@@H](C(C)C)C2=O)C(=O)N1CCC(CC1)CC1C=CC=CC=1
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| MCULE-5598291067 |
0.68 |
C(=O)(C[C@@]([H])(CNC([C@H](C)N)=O)C1C=CC(=CC=1)Cl)N[C@@H](CC(C)C)C(O)=O
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|
| MCULE-7257244561 |
0.68 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(N2[C@@H]3[C@@H](CCC3)OCC2)=O)C1
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| MCULE-2861820158 |
0.68 |
CN(C(C1(C2C=C(C)C=C(C)C=2)CC1)=O)CC(N1CC(C(=O)O)CCC1)=O
|
|
| MCULE-5785097657 |
0.68 |
N1(CC(CC1C(NCCOC)=O)OC1=CC=CC=C1)C(=O)CC1C=CC=CC=1
|
|
| MCULE-3455867465 |
0.68 |
C1(C2=CC=CC=C2)(CC1)C(=O)N1CC2(CCOCC2)N(C(=O)C1)CC
|
|
| MCULE-8922748197 |
0.68 |
N1(C[C@H](C[C@H]1C(NCCOC)=O)OC1=CC=CC=C1)C(=O)CC1C=CC=CC=1
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|
| MCULE-1484134957 |
0.68 |
COC1CN(C(CC(C2C=CC=CC=2)C)=O)C(C(=O)O)C1
|
|
| MCULE-2531589366 |
0.68 |
N1(C[C@H](C[C@H]1C(=O)N1CCCC1)OC1C=CC=CC=1)C(=O)CC1C=CC=CC=1
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|
| MCULE-8849569096 |
0.68 |
CCCOCC(NC(C(N1CCN(C)CC1)=O)CC1=CC=CC=C1)=O
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|
| MCULE-7393003898 |
0.68 |
N1(C[C@H](C[C@H]1C(NC)=O)OC1=CC=CC=C1)C(=O)CC1C=CC=CC=1
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|
| MCULE-1824697530 |
0.68 |
COCCOCCC(NC(C(N1CCCC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-1868068147 |
0.68 |
OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(NCC2OCCCC2)=O)C1
|
|
| MCULE-1077212665 |
0.68 |
N1(CCNC(=O)C1)C(CCCC(=O)N1CCC(CC1)(O)C1=CC=C(C=C1)Cl)=O
|
|
| MCULE-3121744173 |
0.68 |
N1(CC(CC1C(=O)N1CCCC1)OC1C=CC=CC=1)C(=O)CC1C=CC=CC=1
|
|
| MCULE-6403368159 |
0.68 |
CCCC(N1C(C(N2CC(CC3=CC=C(F)C=C3)(CO)CC2)=O)CCCC1)=O
|
|
| MCULE-2640410536 |
0.68 |
N1(CC(CC1C(NC)=O)OC1=CC=CC=C1)C(=O)CC1C=CC=CC=1
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|
| MCULE-4182948938 |
0.68 |
CC(C1C=CC(C2C(C(N(CC(N3CC(C(=O)O)CCC3)=O)C)=O)C2)=CC=1)C
|
|
| MCULE-3403753012 |
0.68 |
[C@H]1(CCCCN)NC(=O)[C@H](CC2C=CC(O)=CC=2)NC(=O)[C@@H](CC(O)=O)NC(=O)CNC(=O)[C@@H](CCCNC(N)=N)NC1=O
|
|
| MCULE-9164230758 |
0.68 |
C(=O)(C(N)CC(O)=O)NC(CC1C=CC=CC=1)C(OC)=O
|
|
| MCULE-7746074248 |
0.68 |
NCCCC[C@H]1C(=O)N[C@@H](CCCNC(=N)N)C(=O)NCC(=O)N[C@@H](CC(=O)O)C(=O)N[C@H](CC2C=CC(O)=CC=2)C(=O)N1
|
|
| MCULE-8763531453 |
0.68 |
COC1CN(C(CC(C2C=CC=CC=2)(C)C)=O)C(C(=O)O)C1
|
|
| MCULE-5704724662 |
0.68 |
C1NC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC2C=CC(O)=CC=2)NC(=O)[C@H](CC(=O)O)NC1=O
|
|
| MCULE-2907492540 |
0.68 |
COC(C1=CC=CC=C1)(OC)CNC(C1N(C(CC(C)(C)C)=O)CCC1)=O
|
|
| MCULE-5905233403 |
0.68 |
C1C2C(CC1N1CC3(C1)N1C[C@@H](C[C@H]1C(=O)N(CC1C=CC=CC=1)C3=O)O)=CC=CC=2
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|
| MCULE-3845775192 |
0.68 |
C(CC1=CC=CC=C1F)(C(O)=O)NC(=O)CN1CCCCC1
|
|
| MCULE-7936054711 |
0.68 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(=O)C1C=CC=CC=1F
|
|
| MCULE-9587160042 |
0.68 |
COC1CN(C(CC(C2C=CC=CC=2)C(C)C)=O)C(C(=O)O)C1
|
|
| MCULE-1622223068 |
0.68 |
N1(CC(=O)N[C@H]2CCCCNC(=O)[C@@H]3CCCN3C([C@@H](CC3C=CC=CC=3)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CC)NC2=O)=O)N=C2C(C=CC=C2)=N1
|
|
| MCULE-6003477415 |
0.68 |
N1(C2([H])CCCC2(CC1([H])C(O)=O)[H])C(=O)C([H])(C)NC([H])(CCC1=CC=CC=C1)C(CCC)=O
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|
| MCULE-5893514097 |
0.68 |
C(O)[C@H](C(N[C@@H](C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CC(=O)N)C(NCC(N[C@@H](C(C)C)C(NCC(N[C@@H](CO)C(NCC(N[C@H](C(N[C@@H](CCCCN)C(N[C@@H](CCCCN)C(N[C@@H]([C@H](O)C)C(N[C@H](CO)C(N[C@@H](C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](C(N[C@H](CCCCN)C(N[C@@H](CCC(N)=O)C(O)=O)=O)=O)C)=O)=O)=O)CC1C=CC=CC=1)=O)=O)=O)=O)=O)C)=O)=O)=O)=O)=O)=O)=O)=O)CC1C=CC=CC=1)=O)N
|
|
| MCULE-6581340578 |
0.68 |
CN(C(C1(C2C=CC=CC=2)CCC1)=O)CC(N1CC(C(=O)O)CCC1)=O
|
|
| MCULE-3894117220 |
0.68 |
C(O)[C@H](C(N[C@@H](C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CC(=O)N)C(NCC(N[C@@H](C(C)C)C(NCC(N[C@@H](CO)C(NCC(N[C@@H](C(C)C)C(N[C@@H](CCCCN)C(N[C@@H](CCCCN)C(N[C@@H]([C@H](O)C)C(N[C@H](CO)C(N[C@@H](C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](C(N[C@H](CCCCN)C(N[C@@H](CCC(N)=O)C(O)=O)=O)=O)C)=O)=O)=O)CC1C=CC=CC=1)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)=O)CC1C=CC=CC=1)=O)N
|
|
| MCULE-4633243104 |
0.68 |
CCCC(N1C(C(NCC(C2=CC=CC=C2)(OC)OC)=O)CCC1)=O
|
|
| MCULE-8527491640 |
0.68 |
C(C1C=CC=CC=1)[C@@H](N)C(NCC(NCC(N[C@H](C(N[C@H]([C@@H](O)C)C(NCC(N[C@H](C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CCCCN)C(N[C@H](CO)C(N[C@H](C(N[C@@H](CCCNC(N)=N)C(N[C@H](CCCCN)C(N[C@@H](CC(C)C)C(N[C@H](C(N[C@H](CC(=O)N)C(N[C@@H](CCC(N)=O)C(O)=O)=O)=O)C)=O)=O)=O)=O)C)=O)=O)=O)=O)C)=O)=O)=O)CC1C=CC=CC=1)=O)=O)=O
|
|
| MCULE-3538229176 |
0.68 |
CCC1OC(C)CN(C(C2N(C(CC3=CC=CC=C3)=O)CCC2)=O)C1
|
|
| MCULE-6334539253 |
0.68 |
C(C1C=CC=CC=1)[C@@H](N)C(NCC(NCC(N[C@H](C(N[C@H]([C@@H](O)C)C(NCC(N[C@H](C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CCCCN)C(N[C@H](CO)C(N[C@H](C(N[C@@H](CCCNC(N)=N)C(N[C@H](CCCCN)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CCCCN)C(N[C@H](CC(=O)N)C(N[C@@H](CCC(N)=O)C(O)=O)=O)=O)=O)=O)=O)=O)C)=O)=O)=O)=O)C)=O)=O)=O)CC1C=CC=CC=1)=O)=O)=O
|
|
| MCULE-6271551184 |
0.68 |
N1(CC)C(C(NCCOC)=O)CC2(CCN(CC2)CCCC2C=CC=CC=2)C1=O
|
|
| MCULE-2363552790 |
0.68 |
N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)C1CCN(CC1)C(=O)C1C=CC=CC=1Cl)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
|
|
| MCULE-7295933426 |
0.68 |
CN(C(C1(C2C=CC=C(C)C=2)CC1)=O)CC(N1CC(C(=O)O)CCC1)=O
|
|
| MCULE-6278912283 |
0.68 |
N12C[C@@H](CC1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)=O)NC(=O)[C@H](OC)C1C=CC=CC=1
|
|
| MCULE-8333276172 |
0.68 |
C(CC1=CC=CC=C1F)(C(O)=O)NC(=O)CN1CCC(CC1)C
|
|
| MCULE-1806009048 |
0.68 |
CN(C(CNC(CCC1C=CC(C)=CC=1)=O)=O)CC(=O)O
|
|
| MCULE-5321978243 |
0.68 |
C1(O)(CCN(CC(=O)NCC2CCCCC2)C1)C1C=CC=CC=1C
|
|
| MCULE-9884420903 |
0.68 |
CN(CC(NC(CCC1CNCC1)=O)CC1C=CC=CC=1)C
|
|
| MCULE-8134471015 |
0.68 |
C1(CC2C(=CC=CC=2)C1)(N1CCN(CC1)CC)C(=O)N1CCC(CC1)OC
|
|
| MCULE-1176111500 |
0.68 |
CC1N(C(CNC(CN)=O)=O)CC(C2=CC=CC=C2)C1
|
|
| MCULE-1383765184 |
0.68 |
[C@@H]12CN(CC3CC3)[C@H](C(=O)N1CCN(CCOC)C2=O)CC1C=CC=CC=1
|
|
| MCULE-5320067843 |
0.68 |
O=C(C1NCCC1)NCC1(C2C=CC=CC=2)CCC1
|
|
| MCULE-3600512625 |
0.68 |
COC1CN(C(CCC2C=CC=CC=2)=O)C(C(=O)O)C1
|
|
| MCULE-1282661257 |
0.68 |
CC(C(C(N1CC(CC2=CC=CC=C2)NCC1)=O)N1C(=O)CCC1)C
|
|
| MCULE-4892837946 |
0.68 |
CO[C@@H]1CN(C)[C@H](C(N2CCC(CC3=CC(C)=CC=C3)(O)CC2)=O)C1
|
|
| MCULE-7389233166 |
0.68 |
N1[C@@H](CC2C=CC=CC=2)CN(CC1=O)CCCCC1=CC=CC=C1
|
|
| MCULE-3665985005 |
0.68 |
CO[C@H]1C[C@@H](C(NCCC2=C(F)C=CC=C2F)=O)NC1
|
|
| MCULE-3258400265 |
0.68 |
CCC(C1C=CC=CC=1)CC(NC1(C(=O)O)CCC1)=O
|
|
| MCULE-1221047171 |
0.68 |
CC(C(N1CC(C2=CC=C(F)C=C2)(O)CC1)=O)(N1CCOCC1)C
|
|
| MCULE-8710345592 |
0.68 |
CC(C(C1C=CC=CC=1)CC(NC1(C(=O)O)CCC1)=O)C
|
|
| MCULE-4822162846 |
0.68 |
C(=O)(C(N)CC1C=CC(O)=CC=1)N[C@@]([H])(C)C(=O)NCC(=O)NC(CC(C)C)C(=O)NCC(OCC)=O
|
|
| MCULE-2454977803 |
0.68 |
CN(CC(N1CC(C)(C)CC(O)CC1)=O)CCC1=CC=CC=C1
|
|
| MCULE-5847456731 |
0.68 |
ClC1=CC=C([C@H]2[C@H](NC(C3N(C4CCOCC4)CCC3)=O)C2)C=C1
|
|
| MCULE-5470020956 |
0.68 |
N1(CCC2C=CC=CC=2)C(=O)CCC1(C)C(NCCC(C)C)=O
|
|
| MCULE-4635458389 |
0.68 |
CO[C@@H]1CN(C)[C@H](C(NCCC2=CC(C#N)=CC=C2)=O)C1
|
|
| MCULE-5685353972 |
0.68 |
CCC(C1C=CC=CC=1)CC(NC(C(=O)O)C1CC1)=O
|
|
| MCULE-5217984585 |
0.68 |
CN1C(C(NCCC2=CC=C(NC(C)=O)C=C2)=O)(C)CC(O)C1
|
|
| MCULE-2216464077 |
0.68 |
O=C(N1CC(CC2=CC=CC=C2)C1)[C@@H]1NC(=O)CC1
|
|
| MCULE-1270342829 |
0.68 |
[C@@H]1(C(O)=O)CN(C[C@H]1C1C=CC=CC=1C)C(=O)CN1CCN(CC1)CC
|
|
| MCULE-7903322362 |
0.68 |
OC(C1=CC=CC=C1)CN1CCN(C(CCC2=CC=CC=C2)=O)CC1
|
|
| MCULE-7548413714 |
0.68 |
CC(C1=CC=C(F)C=C1)CC(N(CC(N1CCCC1)=O)CC1OCCC1)=O
|
|
| MCULE-4184533906 |
0.68 |
CN(CCN(C(C1NC(=O)CC1)=O)CCCC1=CC=CC=C1)C
|
|
| MCULE-6128622964 |
0.68 |
CN1C(C(NC(C(O)=O)CC2=C(O)C=CC=C2)=O)CCCC1
|
|
| MCULE-3586778237 |
0.68 |
CCN(C(CC1C=CC=CC=1)CNC(CCC1CNCC1)=O)CC
|
|
| MCULE-8588433165 |
0.68 |
CC(NC(N1[C@H](C(NCC(C(=O)O)CC2C=CC=CC=2)=O)CCC1)=O)C
|
|
| MCULE-7725770483 |
0.68 |
CCN(C(CNC(CCC1C=CC(C)=CC=1)=O)=O)CC(=O)O
|
|
| MCULE-6088013378 |
0.68 |
C(=O)(C(N)CC1C=CC(=CC=1)O)NC(C)C(=O)NCC(=O)NC(CC(C)C)C(=O)NCC(OCC)=O
|
|
| MCULE-6751482633 |
0.68 |
N1(CCCC2=CC=CC=C2)C(=O)CCC1(C)C(NCCC(C)C)=O
|
|
| MCULE-6398065498 |
0.68 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(COC)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-9781599033 |
0.68 |
C(=O)([C@@H](N)CC1C=CC=CC=1)N[C@@H](CO)C(O)=O
|
|
| MCULE-6403532636 |
0.68 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(=O)C(C)(C)OC)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-3722937855 |
0.68 |
CC(C(C1C=CC=CC=1)CC(NC(C(=O)O)C1CC1)=O)C
|
|
| MCULE-3326727597 |
0.68 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(CC1=CC=C3C(OCCO3)=C1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-9284129224 |
0.68 |
CC1C=CC(CCC(NCC(NCC(=O)O)=O)=O)=CC=1
|
|
| MCULE-5915475222 |
0.68 |
N12C[C@@H](C[C@H]1C(=O)NCCCC[C@H](NC(=O)CCOC)C(N[C@H](C)C(=O)N[C@@H](CC1C3C=CC=CC=3NC=1)C(=O)N[C@H](CC(C)C)C2=O)=O)O
|
|
| MCULE-5926219399 |
0.68 |
CC(C(C(N1C(C)(C)C(C2=CC=CC=C2)CC1)=O)O)(O)C
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|
| MCULE-7756560566 |
0.68 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)[C@@H]1CCCNC1)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
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| MCULE-7283696260 |
0.68 |
C(=O)(C(N)CC1C=CC=CC=1)NC(CO)C(O)=O
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| MCULE-6865185629 |
0.68 |
N12C[C@@H](C[C@H]1C(=O)N[C@H](C)C(=O)N[C@@H](CC(C)C)COC1C=CC(=CC=1)C[C@@H](C(=O)N[C@@H](CC)C2=O)NC(C1=CC=CC=C1)=O)O
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| MCULE-4692502403 |
0.68 |
CCC(C1=CC=CC=C1)CC(N1CCN(C2C(O)CCC2)CC1)=O
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|
| MCULE-3256999227 |
0.68 |
O=C([C@@H]1NC(=O)CC1)N[C@H]1[C@H](C2=CC=CC=C2)OC1
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|
| MCULE-2740619336 |
0.68 |
N12C[C@H](C[C@H]1CN([C@@H](CC1=CC=CC=C1)C2=O)CC1C=NN(C)C=1)OC
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| MCULE-8632450942 |
0.68 |
CN1C(C(N[C@H](C2=CC=CC=C2)CC(N)=O)=O)(C)CC(O)C1
|
|
| MCULE-9706180889 |
0.68 |
C(C(NC(CC1C=CC=CC=1)C(=O)O)=O)CCCCCCCC(NC(CC1C=CC=CC=1)C(=O)O)=O
|
|
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0.68 |
C(=O)(C(CC1=CC=CC=C1)NC(C1CCCCC1)=O)N1CCC2(CC1)OCCO2
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|
| MCULE-7286492712 |
0.68 |
CCCC(C(NCCCC(=O)O)=O)NC(CC1C=CC=CC=1)=O
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| MCULE-7279136720 |
0.68 |
N1(C(C)C)C[C@H](C[C@H]1C(OC)=O)NC(CCC1C=CC(=CC=1)C)=O
|
|
| MCULE-3696714201 |
0.68 |
CCCC(C(N(CCCC(=O)O)C)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-6086501075 |
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O=C([C@H]1NC(=O)CC1)N[C@H]1[C@H](C2=CC=CC=C2)OC1
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|
| MCULE-2444518669 |
0.68 |
N1(CC(O)CN(CCC2=CC=CC=C2)C(=O)C1)C(C(CC)CC)=O
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|
| MCULE-7368312047 |
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[Na+].COC1=CC=C(C2(CC2)CNC(C2N(C3CC3)C(C([O-])=O)CC2)=O)C=C1
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| MCULE-5384733893 |
0.68 |
CN(C(C1NCCC1)=O)CC1CCN(CC(C2=CC=CC=C2)O)CC1
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| MCULE-1880402474 |
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N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1=CC=C(C=C1)OC)C(=O)CCOCC
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| MCULE-8151393509 |
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C(=O)(CN1CCCC(O)C1)N(C1CCN(CC1)C)CCC1C=CC=CC=1
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| MCULE-4117755219 |
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FC1(CC(C(NC(C(N2CCOCC2)=O)CC2=CC=CC=C2)=O)CC1)F
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|
| MCULE-8281268011 |
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CNCC(C(NC(C(N1CCCC1)=O)CC1C=CC=CC=1)=O)C
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|
| MCULE-5060328452 |
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CN(C(C1=C(Cl)C=CC=C1)CNC(C1(N(C)CC(O)C1)C)=O)C
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|
| MCULE-7889776294 |
0.68 |
CC(C(=O)O)N(C(CCC1C=CC=CC=1C)=O)CCNC(=O)C
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|
| MCULE-8097199841 |
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CC(C(NCC(N1C2C(COCC2)C(C2=CC=CC=C2)C1)=O)=O)(C)C
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|
| MCULE-8536473201 |
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CN(C(C1C2(CC2)C1)=O)C(C(=O)O)CC1C=CC=CC=1
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| MCULE-5866677447 |
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C(=O)(C(CC(C)C)NC(CNC(=O)C(C)NC(=O)C(N)CC1=CC=C(C=C1)O)=O)NC(CCCNC(N)=N)C(O)=O
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| MCULE-3052501254 |
0.68 |
N1(CCC2C=CC=CC=2)CC(O)CN(CCCC2C=CC=CC=2)CC1=O
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| MCULE-1786216476 |
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Cl.CO[C@H]1C[C@H](C(NCC2(C3=C(Cl)C=CC=C3)CCC2)=O)NC1
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|
| MCULE-4945076880 |
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CCC1(C(C(N(C(C(=O)O)CC2C=CC=CC=2)C)=O)C1)C
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|
| MCULE-5088860614 |
0.68 |
CO[C@H]1C[C@H](C(NCC2(C3=CC=C(Cl)C=C3)CCOCC2)=O)NC1
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|
| MCULE-3724823002 |
0.68 |
N1(CCCO)CC2(CCC1=O)CCN(CC2)C(=O)[C@H](N)CC1=CC=CC=C1
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|
| MCULE-3034949883 |
0.68 |
N1(CCNC(=O)C1CC(OC)=O)C(CCC1(CCC(=O)N1)CC1C=CC2C(=CC=CC=2)C=1)=O
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| MCULE-7183930013 |
0.68 |
OC([C@H](NC(C1CCCC1)=O)CC1C=CC=CC=1)=O
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|
| MCULE-6754378224 |
0.68 |
C1(CC2C(=CC=CC=2)C1)(C(=O)N[C@H]1CCCCNC1=O)N1C[C@H](C)O[C@H](C)C1
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|
| MCULE-9121498646 |
0.68 |
OC([C@H](NC(CCC1CC1)=O)CC1C=CC=CC=1)=O
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|
| MCULE-8053400581 |
0.68 |
CO[C@H]1C[C@H](C(NCC2(C3=C(Cl)C=CC=C3)CCC2)=O)NC1
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|
| MCULE-2144555501 |
0.68 |
OC([C@H](NC(CCCC1C=CC=CC=1)=O)CC1C=CC=CC=1)=O
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|
| MCULE-2286051698 |
0.68 |
CC(N1[C@@H](C(NC2(C3=CC(F)=CC=C3)CC2)=O)C[C@@H](O)C1)=O
|
|
| MCULE-8111578139 |
0.68 |
COCCCN(C(C(CC1C=CC=CC=1)N)=O)CCOC
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|
| MCULE-2694478090 |
0.68 |
C12(CC1)C(=O)NCCOC1C=CC(=CC=1)C[C@@H](C(=O)N[C@@H](C)C(=O)N[C@H](CC1C=CC=CC=1)C(=O)N2)NC(C1CCC1)=O
|
|
| MCULE-7083776191 |
0.68 |
N1(C[C@@H]2CCCN2C(=O)[C@H]1C)C(=O)C1(C2C=CC(=CC=2)C)CC1
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| MCULE-1040348507 |
0.68 |
CCC(C)C(NC(=O)C(N)([H])CC1C=CC=CC=1)([H])C(=O)N
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|
| MCULE-7708086185 |
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CCCC(C(NCCC(C(=O)O)(C)C)=O)NC(CC1C=CC=CC=1)=O
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|
| MCULE-7744563813 |
0.68 |
C(C1C=CC=CC=1)C(N)C(=O)NC(C(=O)N)CC(C)C
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|
| MCULE-7641434042 |
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OCC1N(CC(NCC(C2=CC=CC=C2)=O)=O)CCC1
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|
| MCULE-8115302899 |
0.68 |
CCN1C(CNC(C(CC2C=CC=CC=2)N)=O)CCC1
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|
| MCULE-3981240800 |
0.68 |
CC(C1C=CC=CC=1C)CC(N(C(C(=O)O)C)CCNC(=O)C)=O
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|
| MCULE-4765204764 |
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NC(C(NCC(N1CCCC1)=O)=O)CC1C=CC=CC=1
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|
| MCULE-5424016708 |
0.68 |
C1C=C(CC(NC(CCCCCCCCCCCCC(C)C)=O)C(=O)O)C=CC=1
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|
| MCULE-2660287465 |
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CC([C@@H](C(=O)O)NC(CC(C1C=CC=CC=1)C(C)C)=O)C
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|
| MCULE-1860198398 |
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C(C1CCC1)(=O)N[C@@H]1CN(C[C@H]1CO)CCCC1C=CC=CC=1
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|
| MCULE-9428476898 |
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CC(C(C(=O)O)NC(CC(C1C=CC=CC=1)C(C)C)=O)C
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|
| MCULE-2490964176 |
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N1(C(CCC2=CC=C(C=C2)F)=O)C[C@H]2CCCN2C(=O)[C@@H]1C
|
|
| MCULE-1760557923 |
0.68 |
O=C(NCCC1C=CC=CC=1)CNC(C1NCCC1)=O
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|
| MCULE-1071058778 |
0.68 |
CCCC(C(NCC(CC(C)C)CCO)=O)NC(CC1=CC=CC=C1)=O
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|
| MCULE-3891638182 |
0.68 |
CCC(C1C=CC=CC=1)CC(NC(C(=O)O)C(C)C)=O
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|
| MCULE-5148817937 |
0.68 |
CNCCC(NC(C(N1CCCC1)=O)CC1C=CC=CC=1)=O
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|
| MCULE-3618515507 |
0.68 |
CC([C@@H](C(NCC(NC(C(=O)N)CC1C=CC=CC=1)=O)=O)N)C
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|
| MCULE-3736331108 |
0.68 |
OC([C@H](NC(C1C2(CC2)C1)=O)CC1C=CC=CC=1)=O
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|
| MCULE-3774782483 |
0.68 |
CN1CCN(C(C(NC(C)=O)CC2=CC=CC=C2)=O)CC1
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|
| MCULE-8661643610 |
0.68 |
N1(C[C@H]2CCCN2C(=O)[C@H]1C)C(=O)C1(C2C=CC(=CC=2)C)CC1
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|
| MCULE-1062536012 |
0.68 |
CCC(C1C=CC=CC=1)CC(N[C@H](C(=O)O)C(C)C)=O
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|
| MCULE-9965497034 |
0.68 |
CC(CC(NCC(NCC(C(=O)O)CC1C=CC=CC=1)=O)=O)(C)C
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| MCULE-7263491781 |
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CC(C(N1CCCC1)=O)N1CCN(C(C(CC2C=CC=CC=2)N)=O)CC1
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|
| MCULE-1048722907 |
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N1(C[C@H]2CCCN2C(=O)[C@@H]1C)C(=O)C1(C2C=CC(=CC=2)C)CC1
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|
| MCULE-1093978033 |
0.68 |
CCC(C(=O)O)(NC(CC(C1C=CC=CC=1)C(C)C)=O)C
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|
| MCULE-4294748073 |
0.68 |
[C@H]1(NC(CNC1=O)=O)CC1C=CC(O)=CC=1
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| MCULE-8671358392 |
0.68 |
N[C@@H](C(N1C(CN2CCCC2)CCC1)=O)CC1=CC=CC=C1
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|
| MCULE-3428896162 |
0.68 |
C1(CC2C=CC(O)=CC=2)C(=O)NCC(=O)N1
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| MCULE-5105084822 |
0.68 |
C(=O)(C(CC1C=CC=CC=1)NC(=O)C(N)CC(N)=O)NC(CC1=CC=CC=C1)C(OC)=O
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| MCULE-5343020534 |
0.68 |
CC1(N(C(CCC2=CC3=C(C=CC=C3)C=C2)=O)CC(O)C1)C
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|
| MCULE-1990899632 |
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CC(C1C=CC=CC=1)CCC(NC(C(=O)O)CC1C=CC=CC=1)=O
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|
| MCULE-9837928484 |
0.68 |
CO[C@H]1C[C@@H](C(N2CCC(C3=CC(F)=C(F)C=C3)CC2)=O)NC1
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|
| MCULE-8519054761 |
0.68 |
CC(C1CCN(C(C(CC2C=CC=CC=2)N)=O)CC1)O
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|
| MCULE-9598619359 |
0.68 |
OC(C(NC(CCCC1C=CC=CC=1)=O)CC1C=CC=CC=1)=O
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|
| MCULE-5992449229 |
0.68 |
CN1C(C(N[C@@H]2C[C@@H](C3=CC(Br)=C(F)C=C3)C2)=O)(C)CC(O)C1
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|
| MCULE-4550348288 |
0.68 |
NCCN(C(CNC(C1NCCC1)=O)=O)CCC1C=CC=CC=1
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| MCULE-3933189231 |
0.68 |
CC1(C(NC(C(=O)O)CC2C=CC=CC=2)=O)CCCC1
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|
| MCULE-9813717838 |
0.68 |
COC1=CC=C(CC2CN(C(C3(N(C)CC(O)C3)C)=O)CCC2)C=C1
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|
| MCULE-7856305056 |
0.68 |
CC(CC(NCC(NC(C(N)=O)CC1=CC=CC=C1)=O)=O)(C)C
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|
| MCULE-4932681444 |
0.68 |
N1(C[C@@H]2CCCN2C(=O)[C@@H]1C)C(=O)C1(C2C=CC(=CC=2)C)CC1
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| MCULE-6555586140 |
0.68 |
N1(C[C@@H]2C[C@@H](CN2C(=O)[C@@H]1CC1C=CC=CC=1)OC)C(=O)CN1C=NN=N1
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| MCULE-2192146473 |
0.68 |
CCC(C1C=CC=CC=1)CN(C(C(=O)O)C)CCNC(=O)C
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|
| MCULE-4429518684 |
0.68 |
COCCNC(CN1CCN(C(C(CC2C=CC=CC=2)N)=O)CC1)=O
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|
| MCULE-1035106979 |
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CCN(CC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)CC
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|
| MCULE-7283399948 |
0.68 |
CCC(C(=O)O)NC(CC(C1C=CC=CC=1)CC)=O
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|
| MCULE-9569898945 |
0.68 |
COCC(C(NC(C(=O)N)CC1C=CC=CC=1)=O)N
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|
| MCULE-6665062797 |
0.68 |
C(C1C=CC=CC=1)C(NC(=O)CNC)([H])C(=O)O
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|
| MCULE-8636544349 |
0.68 |
CCC(C1C=CC=CC=1)CC(NC(C(=O)O)(CC)C)=O
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|
| MCULE-9717776906 |
0.68 |
C(=O)(CN1CCCCCC1)N[C@@H](C)[C@H](O)C1=CC=CC=C1
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|
| MCULE-3502872194 |
0.68 |
CO[C@H](C1=CC=CC=C1)C(N1[C@H](C(N)=O)C[C@H](OC)C1)=O
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|
| MCULE-5632611774 |
0.68 |
OC(CN(C(CCC1=CC=CC=C1)=O)CCC1=CC=CC=C1)=O
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|
| MCULE-8143654445 |
0.68 |
OCC1(C2=CC=CC=C2)CN(C(C(O)=O)=O)CC1
|
|
| MCULE-5127557869 |
0.68 |
CO[C@@H]1CN(C(CC2=C(C)C=CC(C)=C2)=O)[C@H](C(N)=O)C1
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|
| MCULE-8029112328 |
0.68 |
CCC(C(=O)O)NC(CC(C1C=CC=CC=1)C(C)C)=O
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|
| MCULE-8993890172 |
0.68 |
CN(C(CCC1CC1)=O)C(C(=O)O)CC1C=CC=CC=1
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|
| MCULE-1270718273 |
0.68 |
C(=O)([C@@]([H])(CC(C)C)NC([C@@]([H])(CCSC)NC=O)=O)N[C@]([H])(CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-1643311585 |
0.68 |
N1C(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@@H](C(C)C)NC(CN(C(=O)CC2C=CSC=2)CCNC(=O)[C@@H]1[C@@H](C)O)=O
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|
| MCULE-7413204564 |
0.68 |
CCN(C(C1N(C(CCC2=CC=C(F)C=C2)=O)CCC1)=O)CC
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|
| MCULE-5339007041 |
0.68 |
CCCC(C(=O)O)NC(CC(C1C=CC=CC=1)CC)=O
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|
| MCULE-5280735256 |
0.68 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(=O)CN1CCOC1=O)C
|
|
| MCULE-8867531220 |
0.68 |
OC(C(NC(CCC1CC1)=O)CC1C=CC=CC=1)=O
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|
| MCULE-4895883386 |
0.68 |
CC(NC(C1N(C(CC(C)(C)C)=O)CCC1)=O)CCC1=CC=CC=C1
|
|
| MCULE-9609750267 |
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N12C[C@@H](C[C@H]1C(=O)N[C@H](C(C)C)CC[C@@H](C)CC(=O)N[C@@H](CC1C=CC(=CC=1)O)C(=O)NCCCC2=O)NC(COC)=O
|
|
| MCULE-6017355080 |
0.68 |
CCCCC(C(NC(C(=O)O)CC1C=CC=CC=1)=O)CC
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|
| MCULE-2854443628 |
0.68 |
OC1(C2C=CC=CC=2CCC1)CNC(C1NC(=O)CC1)=O
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|
| MCULE-8182383535 |
0.68 |
CN(C(C)=O)CC(N1C[C@H](CO)[C@H](C2=CC=CC=C2)CC1)=O
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|
| MCULE-8255818684 |
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CCC1(C(C(NC(C(O)=O)CC2=CC=CC=C2)=O)C1)C
|
|
| MCULE-7780543005 |
0.68 |
C(=O)(C(CC(C)C)NC(C(CCSC)NC=O)=O)NC(CC1=CC=CC=C1)C(O)=O
|
|
| MCULE-5903060796 |
0.68 |
CCC1C=CC(CCC(NC(C(=O)O)CC2C=CC=CC=2)=O)=CC=1
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|
| MCULE-3702900155 |
0.68 |
CN(C(CCCC1C=CC=CC=1)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-3248605353 |
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CC(NC(C1N(C(C)=O)CCC1)=O)CCC1=CC=CC=C1
|
|
| MCULE-4507947899 |
0.68 |
CC(N(CC(N1CCC(CC(=O)O)CC1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-1691431203 |
0.68 |
CCCC(NCC(NCC(C(=O)O)CC1C=CC=CC=1)=O)=O
|
|
| MCULE-4632989280 |
0.68 |
OC(C(CC1C=CC=CC=1)CNC(C(C1C=CC=CC=1)N1C(=O)CCCC1)=O)=O
|
|
| MCULE-1503505202 |
0.68 |
CN(C(CCC1C=CC(C)=CC=1)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-3454156680 |
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CCCC(C(NCC(CC(=O)O)C)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-5652679160 |
0.68 |
N1(CCC[C@H]1C(=O)NCC(=O)N[C@H](C(=O)N[C@@H]([C@@H](C)CC)C(=O)NCC(=O)N[C@@H](CO)C(=O)N[C@H](C(=O)O)CCCNC(=N)N)CC1C=CC(O)=CC=1)C(=O)[C@H](CC(=O)O)NC(=O)[C@@H](N)CS
|
|
| MCULE-1940500798 |
0.68 |
CC(C(=O)O)N(C(CNC(CCC1C=CC(C)=CC=1)=O)=O)CCNC(=O)C
|
|
| MCULE-9175911777 |
0.68 |
OC(C(NC(C1C2(CC2)C1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-2778906388 |
0.68 |
CCCC(N1C(C(NC(CCC2=CC=CC=C2)C)=O)CCC1)=O
|
|
| MCULE-7677120349 |
0.68 |
C(CN(CCN(CCN(CC(O)=O)CC(=O)NC(CC1=CC=CC=C1)C(O)=O)CC(O)=O)CC(O)=O)(=O)NC(CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-1808520701 |
0.68 |
CC1C=CC(CCC(NCC(NC(CCC(=O)O)(C)C)=O)=O)=CC=1
|
|
| MCULE-2723277834 |
0.68 |
CN(C(C1NC(=O)CC1)=O)CCCC1=CC=CC=C1
|
|
| MCULE-1808093473 |
0.68 |
CC(C(=O)O)N(CC(NCC1(C2C=CC=CC=2)CC1)=O)CCNC(=O)C
|
|
| MCULE-8202583343 |
0.68 |
CN(C(C1CCCC1)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-3366078592 |
0.68 |
O=C(C1N(C2CCCC2)CCC1)NCC1(C2=CC=CC=C2)CC1
|
|
| MCULE-3126037791 |
0.68 |
OCCN(C1CC1)CC(NCC1(C2=CC=CC=C2)CCC1)=O
|
|
| MCULE-8829017028 |
0.68 |
O=C(N1CCC(C(N2C(C(NC3CC3)=O)CCC2)=O)CC1)CCC1=CC=CC=C1
|
|
| MCULE-1771427139 |
0.68 |
CCCC(C(=O)O)(NC(CC(C1C=CC=CC=1)CC)=O)C
|
|
| MCULE-5637920270 |
0.68 |
O=C(N1CC(C2C=CC=CC=2)CC1)C1NCCCC1
|
|
| MCULE-3538242739 |
0.68 |
OCC1(CN(C([C@@H]2[C@@H](C3=CC=CC=C3)C2)=O)CC1)O
|
|
| MCULE-7387185593 |
0.68 |
N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1C=CC(=CC=1)OC)C(C1CCOCC1)=O
|
|
| MCULE-3276252212 |
0.68 |
CC1(C(N2CC(C3C=CC=CC=3)CC2)=O)NCCCC1
|
|
| MCULE-8828249464 |
0.68 |
CCC(C1C=CC=CC=1)C(N1[C@H](C(=O)O)CCC1)=O
|
|
| MCULE-8678027530 |
0.68 |
N1(C[C@H]([C@H](C(O)=O)C1)C1=CC=CC(F)=C1)C(=O)C1(CCCC1)N1CCCC1
|
|
| MCULE-4384406672 |
0.68 |
COCC1CN(C(C(CC2C=CC=CC=2)N)=O)CC1
|
|
| MCULE-7759270942 |
0.68 |
OC(C(NC(C1CCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-1378326760 |
0.68 |
CC(N(CC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)C)C
|
|
| MCULE-9554245676 |
0.68 |
CCC1C=CC(CCC(N[C@@H](C(=O)O)CC2C=CC=CC=2)=O)=CC=1
|
|
| MCULE-9602874923 |
0.68 |
CC(C1C=CC=CC=1)CCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O
|
|
| MCULE-8158920507 |
0.68 |
[C@H](C(=O)N[C@H](C(=O)N)[C@H](O)C)(NC(=O)[C@H](CC(=O)N)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H]([C@H](O)C)NC(=O)[C@H](CO)NC(=O)[C@H](N)C)CC1C=CC(O)=CC=1
|
|
| MCULE-2545592785 |
0.68 |
CC1(C(C(N2CC(C3C=CC=CC=3)CC2)=O)NCCC1)C
|
|
| MCULE-6555030630 |
0.68 |
CC(NC(CNC(CCC1C=CC(C)=CC=1)=O)=O)CCC(=O)O
|
|
| MCULE-3588156538 |
0.68 |
CC1N(C(CN2CC(=O)NCC2)=O)CCC1C1=CC=CC=C1
|
|
| MCULE-8244562920 |
0.68 |
OCC1CN(C(CCC2=CC3=C(C=CC=C3)C=C2)=O)C(CO)C1
|
|
| MCULE-8661892839 |
0.68 |
CC(C1CCNCC1)CC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O
|
|
| MCULE-3283303372 |
0.68 |
CCCC(C(=O)O)NC(CC(C1C=CC=CC=1)C(C)C)=O
|
|
| MCULE-2030919511 |
0.68 |
CC1N(C(C2NCCCC2)=O)CCC1C1C=CC=CC=1
|
|
| MCULE-4356117444 |
0.68 |
CC(C(C(C1=CC=CC=C1)O)NCC(N1CCCCC1)=O)C
|
|
| MCULE-3440484921 |
0.68 |
C(O)(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](CC(C)C)NC(=O)[C@H](CCSC)NC=O
|
|
| MCULE-9779651170 |
0.68 |
N1(CC(=O)NC(=O)C1)C(CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-3910868214 |
0.68 |
OC([C@H](NC(CCC1CCNCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-1378953882 |
0.68 |
N1(C[C@@H](C[C@H]1C(NCCOC)=O)O)C1CCN(CC1)C(=O)CC1C=CC=C(F)C=1
|
|
| MCULE-8940014939 |
0.68 |
CC1C=CC(CCC(NC(C(=O)O)CC2C=CC=CC=2)=O)=CC=1
|
|
| MCULE-6706788496 |
0.68 |
CCC(NCC(N1CC2(CCC2)C(C2=CC=CC=C2)C1)=O)=O
|
|
| MCULE-5053334125 |
0.68 |
OC(C(C(F)(F)F)(C1=CC=CC=C1)O)C(N1C2C(CCCC2)NC(=O)C1)=O
|
|
| MCULE-9774913833 |
0.68 |
CC(C(C(N[C@@H](C(=O)O)C)=O)NC(CC1C=CC=CC=1)=O)C
|
|
| MCULE-9929981679 |
0.68 |
N[C@H]1[C@H](C2C=CC=CC=2)CN(C(CN2C(=O)CCCCCC2)=O)C1
|
|
| MCULE-3847607719 |
0.68 |
CCC(C1C=CC=CC=1)CC(N[C@@H](C(=O)O)CC(C)C)=O
|
|
| MCULE-3199611393 |
0.68 |
NC(C(N1CCN(CC(N2CCCCCC2)=O)CC1)=O)CC1C=CC=CC=1
|
|
| MCULE-9538615568 |
0.68 |
CC(C(N1C[C@@H](C2C=CC=CC=2)[C@H](N)C1)=O)NC(C1CCCC1)=O
|
|
| MCULE-5544896310 |
0.68 |
C(=O)(NCC(C)(O)C1CC1)C(NCCC1C=CC=CC=1)=O
|
|
| MCULE-3425459436 |
0.68 |
CC1CC(C(N2CC(C3C=CC=CC=3)CC2)=O)NCC1
|
|
| MCULE-3814711465 |
0.68 |
O=C(C1CCC1)NC(CC1=CC=CC=C1)CN1CCOCC1
|
|
| MCULE-4955450711 |
0.68 |
OC1C=CC(C[C@@H](C(=O)N[C@@H]([C@@H](C)O)C(=O)N)NC(=O)[C@H](CC(=O)N)NC(=O)[C@@H](NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@@H](NC(=O)[C@H](CO)NC(=O)[C@@H](C)N)[C@@H](C)O)[C@@H](C)O)=CC=1
|
|
| MCULE-3841164491 |
0.68 |
CC(N(CC(N1CCC(C(O)=O)CC1)=O)CCC1=CC=CC=C1)=O
|
|
| MCULE-9818479826 |
0.68 |
C1(=O)N(CCCC1(CNCCN1CCCC1)O)CCC1C=CC=CC=1
|
|
| MCULE-6723902790 |
0.68 |
CC1C=CC(CCC(NCC(NC(C(=O)O)C2COCCC2)=O)=O)=CC=1
|
|
| MCULE-8702801262 |
0.68 |
CC(C(NC(C(=O)O)CC1C=CC=CC=1)=O)CC1C=CC(C)=CC=1
|
|
| MCULE-6081780480 |
0.68 |
CCCC(C1C=CC=CC=1)C(N(CC(N1CCC(C(=O)O)CC1)=O)C)=O
|
|
| MCULE-9859088716 |
0.68 |
CN1C(C(NCC(C2=CC(Cl)=CC=C2)N2CCCC2)=O)(C)CC(O)C1
|
|
| MCULE-1339443303 |
0.68 |
N1(CCCC(C2C=CC=CC=2)C1)C(=O)CN1CCCCC1=O
|
|
| MCULE-4363937156 |
0.68 |
COC1(CCC1)CC(NC(CC1=CC=CC=C1)CN(C)C)=O
|
|
| MCULE-4089273042 |
0.68 |
NC(C(N1CCN(CC(N2CCCCC2)=O)CC1)=O)CC1C=CC=CC=1
|
|
| MCULE-3989666498 |
0.68 |
CC1C=CC(CCC(N[C@@H](C(=O)O)CC2C=CC=CC=2)=O)=CC=1
|
|
| MCULE-5614760176 |
0.68 |
CN(CC(N1C[C@@H](C2=CC=C(Cl)C=C2)[C@H](CO)C1)=O)C
|
|
| MCULE-7832479646 |
0.68 |
C(=O)(N[C@@H](C(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C(O)=O)C1(C2C=CC=CC=2)CCN(CC1)C(=O)OC(C)(C)C
|
|
| MCULE-5022548642 |
0.68 |
OC(C1=CC=CC=C1)CC(NCC1NCCC1)=O
|
|
| MCULE-6819141361 |
0.68 |
NC(C(NC(C(O)=O)CC1=CC=C(O)C=C1)=O)CO
|
|
| MCULE-6700999063 |
0.68 |
N1[C@@H](COCC2C=CC=CC=2)C(=O)N[C@H](CC2=CC=CC=C2)C1=O
|
|
| MCULE-5398656384 |
0.68 |
O[C@]1(C(=O)N[C@H](CC2C=CC=CC=2)C(N)=O)C[C@H]([C@@H]([C@H](C1)NC(=O)NC1CCCCC1)O)O
|
|
| MCULE-1398655320 |
0.68 |
N[C@H]1[C@H](C2C=CC=CC=2)CN(C(CCNC(C2NCCC2)=O)=O)C1
|
|
| MCULE-5370638071 |
0.68 |
N12CCC[C@@H]1C(=O)N[C@@H](C(C)C)C(=O)N[C@H](CN(C(=O)CN1CCOC1=O)CC(=O)N[C@@H](C)C2=O)CC1=CC=CC=C1
|
|
| MCULE-7885054161 |
0.68 |
C(C1C=CC(O)=CC=1)[C@@H](N)C(NCC(NCC(N[C@@H](C(N[C@H](CC(C)C)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CCC(N)=O)C(N[C@@H](C(N[C@@H](CCCCN)C(N[C@@H](C(C)C)C(N[C@@H](C(C)C)C(N[C@@H]([C@@H](O)C)C(O)=O)=O)=O)=O)=O)CC1C=CC=CC=1)=O)=O)=O)=O)=O)CC1C=CC=CC=1)=O)=O)=O
|
|
| MCULE-5459038525 |
0.68 |
CCCC(C(NCC1(C(=O)O)CC1)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-8633041568 |
0.68 |
CC(N1[C@@H](C(NC[C@H]2OC[C@@H](C3=CC=CC=C3)C2)=O)C[C@@H](O)C1)=O
|
|
| MCULE-9779401409 |
0.68 |
N1(C[C@H](C[C@H]1C(NC)=O)OC1=CC=CC=C1)C(=O)C1(C2C=CC(=CC=2)OC)CC1
|
|
| MCULE-5406056315 |
0.68 |
CC(C(=O)O)N(CC(NCC1(C2C=CC=CC=2)CCCC1)=O)CCNC(=O)C
|
|
| MCULE-5419343387 |
0.68 |
C(=O)(C(CC1C=CC(=CC=1)N(CCCl)CCCl)NC(C)=O)NC(CC(C)C)C(O)=O
|
|
| MCULE-1931149980 |
0.68 |
O[C@@H]1C[C@](C2=CC=CC=C2)(C(N2C[C@@H](O)CC2)=O)C1
|
|
| MCULE-1683393537 |
0.68 |
CN(C(C1=CC=CC=C1)CNC(CN1CC(O)(C)CCC1)=O)C
|
|
| MCULE-5077157383 |
0.68 |
C(=O)(OC(C)(C)C)N1CCC(CC1)(C1C=CC=CC=1)C(=O)N[C@H](C)C(=O)N[C@@H](CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-9361165557 |
0.68 |
CCCC(N1C(C(N2C(CC3=CC=C(C)C=C3)CCC2)=O)CCC1)=O
|
|
| MCULE-8182635618 |
0.68 |
CC(CC(C(=O)O)CNC(C(C(C)C)NC(CC1C=CC=CC=1)=O)=O)C
|
|
| MCULE-2665968479 |
0.68 |
C(=O)(N[C@H](C(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C(O)=O)C1(C2C=CC=CC=2)CCN(CC1)C(=O)OC(C)(C)C
|
|
| MCULE-5467375052 |
0.68 |
N1(C[C@H](C[C@H]1C(NCCOC)=O)OC1=CC=CC=C1)C(=O)C1(C2C=CC(=CC=2)OC)CC1
|
|
| MCULE-8085748675 |
0.68 |
C1(CCCN(CCCC2C=CC=CC=2)C1=O)(O)CN1CCN(CC1)C
|
|
| MCULE-3835947620 |
0.68 |
C(=O)(OC(C)(C)C)N1CCC(CC1)(C1C=CC=CC=1)C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-7864856633 |
0.68 |
CCC(C(O)=O)N1CCN(C(CCC2=CC=CC=C2)=O)CCC1
|
|
| MCULE-4490196788 |
0.68 |
N12CCN(C[C@@H]1C(N[C@H](CO)C2=O)=O)CCCC1=CC=CC=C1
|
|
| MCULE-5283536431 |
0.68 |
N12C[C@@H](C[C@H]1C(=O)N[C@H](C(C)C)CC[C@@H](C)CC(=O)N[C@@H](CC1=CC=C(C=C1)O)C(=O)NCCCC2=O)NC(=O)CCOC
|
|
| MCULE-7441043408 |
0.68 |
CC(CC(C1C=CC=CC=1)CNC(C1NCCCC1)=O)O
|
|
| MCULE-8565974058 |
0.68 |
COCC1(C2=CC=CC=C2)CN(C(CN2C(=O)CCCC2)=O)C1
|
|
| MCULE-5986268317 |
0.68 |
NC1C2CC(C(NC(C(=O)N)CC3C=CC=CC=3)=O)CC1CCC2
|
|
| MCULE-1248624517 |
0.68 |
CC(CC(NC(C(NCC(C(=O)O)CC1C=CC=C(C)C=1)=O)C(C)C)=O)C
|
|
| MCULE-5044943255 |
0.68 |
N1(C[C@@H]([C@@H](N(C)C)C1)O)C(=O)CC(C1=CC=CC=C1)C1=CC=CC=C1
|
|
| MCULE-8859894505 |
0.68 |
CCCCCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O
|
|
| MCULE-1533438954 |
0.68 |
O=C1N([C@H](C(N)=O)CC2C=CC=CC=2)CC[C@@H]2[C@@H](CCN(C(=O)C(C)(C)C)C2)C1
|
|
| MCULE-7927969758 |
0.68 |
CC1=CC=C(CCC(NCC(N2CCC(OCCCN)CC2)=O)=O)C=C1
|
|
| MCULE-4662961283 |
0.68 |
CN([C@H]1[C@H](NC([C@H](CC2=CC=CC=C2)O)=O)CCC1)C
|
|
| MCULE-7791416477 |
0.68 |
N1(CC(CC1C(=O)N1CCCC1)OC1C=CC=CC=1)C(=O)C1(C2C=CC(=CC=2)OC)CC1
|
|
| MCULE-4247666387 |
0.68 |
C1(CCCN(CCCC2C=CC=CC=2)C1=O)(O)CN1CCN(CC1)CC
|
|
| MCULE-1898484072 |
0.68 |
CCCC(CC(NC(C(=O)O)CC1C=CC=CC=1)=O)C
|
|
| MCULE-9377978619 |
0.68 |
N1(C[C@H](C[C@H]1C(=O)N1CCCC1)OC1C=CC=CC=1)C(=O)C1(C2C=CC(=CC=2)OC)CC1
|
|
| MCULE-6708755622 |
0.68 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(CC1C=CC=CC=1)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-8955069102 |
0.68 |
OC(C(NC(C(C1CC1)C1CC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-2506718652 |
0.68 |
COC1CC(NC(C(CC2C=CC=CC=2)N)=O)CC1
|
|
| MCULE-4539882917 |
0.68 |
N12C[C@@H](C[C@H]1C(=O)NCCCC[C@H](NC(=O)C1(C3C=CC=CC=3)CC1)C(N[C@H](C)C(=O)N[C@@H](CC1C3C=CC=CC=3NC=1)C(=O)N[C@H](CC(C)C)C2=O)=O)O
|
|
| MCULE-8407512226 |
0.68 |
C(C(NC(C(=O)O)CC1C=CC=CC=1)=O)CCCC(NC(C(=O)O)CC1C=CC=CC=1)=O
|
|
| MCULE-8707590504 |
0.68 |
N1(CC(CC1C(NC)=O)OC1=CC=CC=C1)C(=O)C1(C2C=CC(=CC=2)OC)CC1
|
|
| MCULE-8984878263 |
0.68 |
[C@@]1(O)(CN(C[C@H]1C)CC(NCCC1=CC=C(C=C1)F)=O)C1CC1
|
|
| MCULE-9847144217 |
0.68 |
CCC1C=CC(C(CC(N2C(C(=O)O)CCC2)=O)C)=CC=1
|
|
| MCULE-3144645738 |
0.68 |
CC(C[C@@H](C(=O)O)NC(CNC(CC1C=CC(C)=CC=1)=O)=O)C
|
|
| MCULE-1018427110 |
0.68 |
CCC(N1C(C(N2C[C@@H](C3C=CC=CC=3)[C@H](N)C2)=O)CCCC1)=O
|
|
| MCULE-9172497161 |
0.68 |
CC(CC1C=CC(CCC(N2C(C(=O)O)CCC2)=O)=CC=1)C
|
|
| MCULE-2973271724 |
0.68 |
OC(C1(NC(CNC(CC2C=CC=C3C=2C=CC=C3)=O)=O)CCC1)=O
|
|
| MCULE-1701843786 |
0.68 |
CC(C(N1C(C(N2C[C@@H](C3C=CC=CC=3)[C@H](N)C2)=O)CCCC1)=O)C
|
|
| MCULE-7334683278 |
0.68 |
CCCCC(C(NC(C(=O)O)CC1C=CC=CC=1)=O)C
|
|
| MCULE-9047082286 |
0.68 |
CC(C(C1C=CC=CC=1)C(N(CC(N1CCC(C(=O)O)CC1)=O)C)=O)C
|
|
| MCULE-3995300109 |
0.68 |
CN(C(C1(CCC1)CC1C=CC=CC=1)=O)CC(N1CCC(C(=O)O)CC1)=O
|
|
| MCULE-4322343904 |
0.68 |
OC1CN([C@@H]2[C@H](NC(CC3=CC4=C(C=CC=C4)C=C3)=O)CCC2)CC1
|
|
| MCULE-8963325369 |
0.68 |
CC(C(NCC(C(=O)O)CC1C=CC=C2C=1C=CC=C2)=O)NC(C(C)(C)C)=O
|
|
| MCULE-8083327287 |
0.68 |
NCCCNC(C(NC(C12CC3CC(CC(C3)C1)C2)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-5788586700 |
0.68 |
CC(C1C=CC(CCC(N2[C@H](C(=O)O)CCC2)=O)=CC=1)C
|
|
| MCULE-9034384634 |
0.68 |
CC(CN1CCN(C([C@]2(C3=CC=CC=C3)C[C@H](O)C2)=O)CC1)(O)C
|
|
| MCULE-7201155559 |
0.68 |
CCCC(N1C(C(N2C[C@@H](C3C=CC=CC=3)[C@H](N)C2)=O)CCCC1)=O
|
|
| MCULE-8726000634 |
0.68 |
CC(C1C=CC(CCC(N2C(C(=O)O)CCC2)=O)=CC=1)(C)C
|
|
| MCULE-6612061356 |
0.68 |
N1(CC[C@@]([C@@H](O)C1)(C)O)C(=O)C(CCC1C=CC=CC=1)=O
|
|
| MCULE-2628811658 |
0.68 |
N12C[C@@H](C[C@H]1C(=O)NCCC[C@H](NC(=O)C1=CC=CN1)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C)C2=O)O
|
|
| MCULE-6469657822 |
0.68 |
O=C(N1C(C(NC2CC2)=O)CCC1)CC(C1=CC=CC=C1)C1=CC=CC=C1
|
|
| MCULE-4996345830 |
0.68 |
CC(N1C(C(NCC2(C3=CC=CC=C3)CCCCC2)=O)CCC1)=O
|
|
| MCULE-2201959879 |
0.68 |
CCC(C(C1C=CC=CC=1)C(N(CC(N1CCC(C(=O)O)CC1)=O)C)=O)C
|
|
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0.68 |
CC(C1C=CC(CCC(N2[C@@H](C(=O)O)CCC2)=O)=CC=1)C
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FC1=CC=C(C2(CC2)CNC(C2N(C(C3CC3)=O)CCC2)=O)C=C1
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|
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0.68 |
O=C(C(NC1CCOCC1)CC1=CC=CC=C1)NC1CC1
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|
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0.68 |
CCC1C=CC(CCC(N2C(C(=O)O)CCC2)=O)=CC=1
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|
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0.68 |
CCC(C1C=CC=CC=1)C(N(CC(N1CCC(C(=O)O)CC1)=O)C)=O
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|
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0.68 |
C1(CCCN(CCC2=CC=CC=C2)C1=O)(O)CN1CCN(CC1)CC
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|
| MCULE-4008931151 |
0.68 |
CCC1C=CC(C(CC(N2C(C(=O)O)(C)CCC2)=O)C)=CC=1
|
|
| MCULE-5580309953 |
0.68 |
N1(C[C@H](C[C@H]1C(=O)NC1CC1)OC1=CC=CC=C1)C(=O)C1(C2C=CC(=CC=2)OC)CC1
|
|
| MCULE-3713400671 |
0.68 |
C1(CCCN(CCCC2C=CC=CC=2)C1=O)(O)CN1CCN(CC1)CCC
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|
| MCULE-5148362172 |
0.68 |
CCC(C(=O)O)NC(C(C(C)C)NC(CC1C=CC2C=CC=CC=2C=1)=O)=O
|
|
| MCULE-6154109496 |
0.68 |
CC(C1C=CC(F)=CC=1)CC(N(C(C(=O)O)C)CCNC(=O)C)=O
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|
| MCULE-6418908451 |
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CCC(C(N1CCOCC1)CNC(C(CC1C=CC=CC=1)N)=O)CC
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0.68 |
CC(C1C=CC(C(CC(N2C(C(=O)O)CCC2)=O)C)=CC=1)C
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|
| MCULE-5623638752 |
0.68 |
CN(C(C1(CC1)CC1C=CC=CC=1)=O)CC(N1CCC(C(=O)O)CC1)=O
|
|
| MCULE-5081223125 |
0.68 |
C1(CCCN(CCC2=CC=CC=C2)C1=O)(O)CN1CCN(CC1)C(C)C
|
|
| MCULE-3141986469 |
0.68 |
CC(CCCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)(C)C
|
|
| MCULE-5902828785 |
0.68 |
CC(NC(C1N(C(C)=O)CCC1)=O)CC1=CC=C(Br)C=C1
|
|
| MCULE-6049505655 |
0.68 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)NCCN(C(=O)C1C=CC=CN=1)CC(=O)N[C@@H]([C@@H](C)CC)C2=O)O
|
|
| MCULE-2351961948 |
0.68 |
CC(C1C=CC(CCC(N2C(C(=O)O)(C)CCC2)=O)=CC=1)C
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|
| MCULE-1420438373 |
0.68 |
N1C(=O)[C@@H](C)NC(=O)[C@H](CC2=CC=C(OC[C@H](CC3C=CC=CC=3)NC(=O)[C@@H](C(C)C)NC(=O)[C@@H]1[C@@H](C)O)C=C2)NC(CCCN1CCCCC1=O)=O
|
|
| MCULE-1986128784 |
0.68 |
C(CC1CCN(CC1)CC)(=O)N[C@@H](CC1=CC=C(C=C1)O)C(O)=O
|
|
| MCULE-1818572667 |
0.68 |
CC(C1CN(C(CN(C(C)=O)CCC2=CC=CC=C2)=O)CCC1)O
|
|
| MCULE-2378408171 |
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O=C(C1N(C(C2CC2)=O)CCC1)NCC1(C2=CC=CC=C2)CCCC1
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|
| MCULE-7322452257 |
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C1(CCCN(CCCC2C=CC=CC=2)C1=O)(O)CN1CCN(CC1)CCO
|
|
| MCULE-6949388384 |
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CC1C=CC(CCC(N2C(C(=O)O)(C)CCC2)=O)=CC=1
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|
| MCULE-1155193701 |
0.68 |
CC(C[C@@H](C(=O)O)NC(CNC(CCCC1C=CC2C=CC=CC=2C=1)=O)=O)C
|
|
| MCULE-3687269009 |
0.68 |
N[C@H]1[C@H](C2C=CC=CC=2)CN(C(CN2C(=O)CCCCC2)=O)C1
|
|
| MCULE-3093886934 |
0.68 |
CC(CC1C=CC(CCC(N2[C@@H](C(=O)O)CCC2)=O)=CC=1)C
|
|
| MCULE-6540148678 |
0.68 |
N1(C[C@H](C[C@H]1C(=O)N1CCOCC1)OC1=CC=CC=C1)C(CCC1C=CC(=CC=1)OC)=O
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|
| MCULE-5406109390 |
0.68 |
OC(CNC(C1N2CCCCC2CC1)=O)CCC1=CC=CC=C1
|
|
| MCULE-2500055069 |
0.68 |
N1(CCN2CCC(CC2)O)CC(C)(C2=CC=CC=C2)CCC1=O
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|
| MCULE-8477398897 |
0.68 |
COCCC(C(=O)O)NC(CN(C(=O)C)CCC1C=CC=CC=1)=O
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|
| MCULE-5705964617 |
0.68 |
CCC(C1C=CC(C)=CC=1)CC(NC(C(=O)O)CCOC)=O
|
|
| MCULE-5943275977 |
0.68 |
CCC1=CC=C(CCC(N2[C@@H](C(O)=O)CCC2)=O)C=C1
|
|
| MCULE-5323899577 |
0.68 |
N1(C[C@H](C[C@@H]1C(=O)N1CCOCC1)OC1C=CC=CC=1)C(CCC1C=CC(=CC=1)OC)=O
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|
| MCULE-1028241764 |
0.68 |
CN1CCC(C2=CC=CC=C2)(CNC(C23NC(=O)C4C2CC(C4)C3)=O)CC1
|
|
| MCULE-2117723221 |
0.68 |
CC(C1C=CC(CCC(N2[C@H](C(=O)O)CCC2)=O)=CC=1)(C)C
|
|
| MCULE-9087754955 |
0.68 |
CCC(C(=O)O)(CNC(CNC(CCC1C=CC(C)=CC=1)=O)=O)CC
|
|
| MCULE-9764203900 |
0.68 |
CC(C(N1CCOCC1)C)NC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O
|
|
| MCULE-2058889868 |
0.68 |
CC1C=CC(CCC(N2C(C(=O)O)CCC2)=O)=CC=1
|
|
| MCULE-8591911608 |
0.68 |
N1(CC(CC1C(=O)N1CCOCC1)OC1=CC=CC=C1)C(CCC1C=CC(=CC=1)OC)=O
|
|
| MCULE-6866833941 |
0.68 |
CC(N1C(C(NC(CC2C=CC=CC=2)CCC(=O)O)=O)CCCC1)=O
|
|
| MCULE-9912793721 |
0.68 |
OC(C(NC(C1(CC1)CC1C=CC=CC=1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-6169212638 |
0.68 |
N1(CC(CC1C(NCCOC)=O)OC1=CC=CC=C1)C(=O)C1(C2C=CC(=CC=2)OC)CC1
|
|
| MCULE-4331713633 |
0.68 |
OC(CCC(NC(CN1C(=O)CCCCC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-2181175654 |
0.68 |
NC(C(NC(C1C2(CCNCC2)C1)=O)CC1C=CC=CC=1)=O
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|
| MCULE-8384128203 |
0.68 |
CC(C[C@@H](C(=O)O)NC(CNC(C(C1C=CC(C)=CC=1)(C)C)=O)=O)C
|
|
| MCULE-1209559605 |
0.68 |
N1(CC(=O)N2CCOCC2)C(=O)CC(CC1=O)C1=CC=CC=C1
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|
| MCULE-2110937119 |
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CC(C1C=CC(CCC(N2C(C(=O)O)CCC2)=O)=CC=1)C
|
|
| MCULE-8547801174 |
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COCCNCC(NCC(C1C=CC=CC=1)CC(O)C)=O
|
|
| MCULE-5658211702 |
0.68 |
N1(C[C@H](C[C@H]1C(NCC)=O)N)C(CCC1=CC=C(C(C)=C1)C)=O
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|
| MCULE-8525996807 |
0.68 |
CCC1C=CC(CCC(N2[C@H](C(=O)O)CCC2)=O)=CC=1
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|
| MCULE-8587399695 |
0.68 |
CN(C(CNC([C@]1(C2=CC=CC=C2)C[C@H](O)C1)=O)=O)C
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|
| MCULE-7062306527 |
0.68 |
N1(CCNC(=O)C1CC1C=CC=CC=1)C(CCCC1C=CC(=CC=1)Cl)=O
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|
| MCULE-3188934221 |
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CCCCC(C(N(C(C(=O)O)CC1C=CC=CC=1)C)=O)C
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|
| MCULE-8898668641 |
0.68 |
CC(N(CC(N1CC(C(O)=O)(C)CC1)=O)CCC1=CC=CC=C1)=O
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|
| MCULE-4466960577 |
0.68 |
CCC(N1C(C(NC(CC2C=CC=CC=2)CCC(=O)O)=O)CCCC1)=O
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|
| MCULE-1046705386 |
0.68 |
OC([C@@H](NC(C(NC1CC1)=O)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-9391790483 |
0.68 |
C[C@@H](CN1CCN(C([C@]2(C3=CC=CC=C3)C[C@H](O)C2)=O)CC1)O
|
|
| MCULE-1426770978 |
0.68 |
OC(CCC(NC(CN1C(=O)CCCCCC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-3977918559 |
0.68 |
CC(OCCCNC(CN1C(C)C(C2=CC=CC=C2)CC1)=O)C
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|
| MCULE-9450172176 |
0.68 |
CCC1C=CC(CC(NCC(N[C@H](C(=O)O)CC(C)C)=O)=O)=CC=1
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|
| MCULE-5597905890 |
0.68 |
O=C(N1C(CC2=CC=CC=C2)C(=O)NCCC1)C1NC(=O)CCCC1
|
|
| MCULE-7874155689 |
0.68 |
CCC(C1C=CC(C)=CC=1)CC(N1C(C(=O)O)(C)CCC1)=O
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|
| MCULE-5593406092 |
0.68 |
CCC(C1C=CC=CC=1)(C(N(CC(N1CCC(C(=O)O)CC1)=O)C)=O)CC
|
|
| MCULE-3851942703 |
0.68 |
CC(NC(C(NCC(C(=O)O)CC1C=CC=C2C=1C=CC=C2)=O)C1CCCC1)=O
|
|
| MCULE-7106412676 |
0.68 |
CC(CC1C=CC(CCC(N2[C@H](C(=O)O)CCC2)=O)=CC=1)C
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|
| MCULE-4793945355 |
0.68 |
N1(C(C)C)CCC(CC1)CC(=O)N[C@@H](CC1C=CC(=CC=1)O)C(N)=O
|
|
| MCULE-2280359940 |
0.68 |
CC(C(NC(CC1C=CC=CC=1)CCC(=O)O)=O)NC(C1CCCC1)=O
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|
| MCULE-8549232460 |
0.68 |
CCC1C=CC(CCC(N2C(C(=O)O)(C)CCC2)=O)=CC=1
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|
| MCULE-7958126388 |
0.68 |
CCC1C=CC(C(C(NCC(N[C@H](C(=O)O)CC(C)C)=O)=O)(C)C)=CC=1
|
|
| MCULE-3988646559 |
0.68 |
CN(C(CNC(CC1C=CC=CC=1)=O)=O)CC(N1CC(C(=O)O)CCC1)=O
|
|
| MCULE-2362774952 |
0.68 |
CCCC(CC(N(C(C(=O)O)CC1C=CC=CC=1)C)=O)C
|
|
| MCULE-2737562927 |
0.68 |
CC(C(NCC(C(=O)O)CC1C=CC2C=CC=CC=2C=1)=O)NC(C(C)(C)C)=O
|
|
| MCULE-2597796629 |
0.68 |
CC(NC(C(NCC(C(=O)O)CC1C=CC2C=CC=CC=2C=1)=O)C1CCCC1)=O
|
|
| MCULE-1081510974 |
0.68 |
CC(CC1(C(NC(C(=O)O)CC2C=CC=CC=2)=O)CCC1)C
|
|
| MCULE-7444809259 |
0.68 |
CC(N(CC(N1CC(C(=O)O)CC1)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-5311879347 |
0.68 |
CC[C@@H]([C@@H](C(=O)O)NCC(NCC1(C2C=CC=CC=2)CCOCC1)=O)C
|
|
| MCULE-2487040170 |
0.68 |
N1(CC[C@H]([C@H](O)C1)C1=CC=C2C(C=CC=C2)=C1)C(=O)C(C)(C)NC
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|
| MCULE-2372214477 |
0.68 |
CC(C(NCC(C(=O)O)CC1C=CC=C(C)C=1)=O)NC(C(C)(C)C)=O
|
|
| MCULE-2038816229 |
0.68 |
N[C@H]1[C@H](C2C=CC=CC=2)CN(C([C@H]2N(C(=O)N)CCC2)=O)C1
|
|
| MCULE-1142185649 |
0.68 |
CCC(C1C=CC(C)=CC=1)CC(N1C(C(=O)O)CCC1)=O
|
|
| MCULE-6662509565 |
0.68 |
N1(C(CCC2C=CC=C(O)C=2)=O)C[C@H]2CCCN2C(=O)[C@H]1C
|
|
| MCULE-4145147880 |
0.68 |
CC1C=CC=C(CC(C(=O)O)CNC(CNC(CC2CCCCC2)=O)=O)C=1
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|
| MCULE-8171882948 |
0.68 |
CC1C=CC(CCC(N2[C@H](C(=O)O)CCC2)=O)=CC=1
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|
| MCULE-7478591581 |
0.68 |
CC(C(=O)O)N(C(CCC1C=CC(F)=CC=1)=O)CCNC(=O)C
|
|
| MCULE-6735612287 |
0.68 |
CC(C1=CC(Cl)=CC=C1)C(N1[C@@H](CO)CN2[C@@H](CCC2)C1)=O
|
|
| MCULE-5184469766 |
0.68 |
CCCCC(C(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)C
|
|
| MCULE-9533235267 |
0.68 |
N12C[C@@H](CC1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)=O)NC(=O)[C@@H]1CCCO1
|
|
| MCULE-8942820056 |
0.68 |
CCN(C(CC1=CC=CC=C1)CNC(C1(OC)CCNCC1)=O)CC
|
|
| MolPort-039-345-912 |
0.68 |
CC(C)C1CCC(CC1)C(=O)NC(CC1=CC=CC=C1)C(=O)N1CCC(CC1)C(N)=O
|
|
| MolPort-046-697-574 |
0.68 |
CCN1CC2(C1)CN(C[C@@H]1C[C@@H](O)CN21)C(=O)CC1=CC=CC=C1
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|
| MolPort-046-697-577 |
0.68 |
O[C@@H]1C[C@H]2CN(CC3(CN(CCC4=CC=CC=C4)C3)N2C1)C(=O)CC1=CC=CC=C1
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| MolPort-020-086-937 |
0.68 |
CC(NC(=O)C(CC1=CC=CC=C1)N(C)C)C(=O)N1CCOCC1
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|
| MolPort-038-424-828 |
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O[C@H]1C[C@@H](C1)C(CC1=CC=CC=C1)NC(=O)CN1CCCC1=O
|
|
| MolPort-042-673-353 |
0.68 |
CC(C)N1CC2(C1)CN(C[C@@H]1C[C@@H](O)CN21)C(=O)CC1=CC=CC=C1
|
|
| MolPort-046-697-576 |
0.68 |
CC(C)CN1CC2(C1)CN(C[C@@H]1C[C@@H](O)CN21)C(=O)CC1=CC=CC=C1
|
|
| MolPort-020-200-473 |
0.68 |
CC(O)CNC(=O)C1(CC2=CC=CC=C2C1)N(C)CCC1=CC=CC=C1
|
|
| MolPort-045-936-464 |
0.68 |
CC(C)C[C@@H]1NC(=O)[C@@H]2CCC[C@H]2NC(=O)[C@H](C)NC(=O)C2C[C@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)[C@H]1CCCO1
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|
| MolPort-046-697-581 |
0.68 |
O[C@@H]1C[C@H]2CN(CC3(CN(C3)C(=O)CC3=CC=CC=C3)N2C1)C(=O)CC1=CC=CC=C1
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|
| MolPort-046-551-234 |
0.68 |
CCC1=CC=C(CCN2C[C@H](C[C@H]2C(N)=O)OC)C=C1
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|
| MolPort-027-864-980 |
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CC(=O)N1CCC(CC1)C(=O)N[C@H]1CN(CCO)C[C@@H]1C1=CC=CC=C1
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|
| MolPort-021-745-946 |
0.68 |
CC(C)[C@H]1CC[C@@H](CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(=O)N1CCC(CC1)C(N)=O
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|
| MolPort-046-697-571 |
0.68 |
CC(C)C(=O)N1C[C@@H]2C[C@@H](O)CN2C2(CN(C2)C(=O)CC2=CC=CC=C2)C1
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|
| MolPort-046-697-547 |
0.68 |
CC(=O)N1C[C@@H]2C[C@@H](O)CN2C2(CN(C2)C(=O)CC2=CC=CC=C2)C1
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| MolPort-020-125-481 |
0.68 |
COC(=O)CCCNC(=O)C1CCCN1C(=O)CC1=CC=CC=C1
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| MolPort-035-814-001 |
0.68 |
CC(C)[C@H]1CC[C@@H](CC1)C(=O)N[C@H](CC1=CC=CC=C1)C(=O)N1CCC(CC1)C(N)=O
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|
| MolPort-046-697-679 |
0.68 |
CN1CC2(C1)CN(C[C@@H]1C[C@@H](O)CN21)C(=O)CC1=CC=CC=C1
|
|
| MolPort-046-697-579 |
0.68 |
CC(=O)N1CC2(C1)CN(C[C@@H]1C[C@@H](O)CN21)C(=O)CC1=CC=CC=C1
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|
| MolPort-020-197-126 |
0.68 |
CC(CO)NC(=O)C1(CC2=CC=CC=C2C1)N(C)CCC1=CC=CC=C1
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|
| MolPort-038-403-532 |
0.68 |
CN1CCN(CC1)[C@H]1CN(C[C@@H]1O)C(=O)C1(CC1)C1=CC=CC=C1
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|
| MolPort-002-321-892 |
0.68 |
CCOC(=O)CCNC(=O)CN1CC(CC1=O)C1=CC=CC=C1
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|
| MolPort-046-557-491 |
0.68 |
COC1=CC=C(C[C@@H]2NC(=O)[C@H](CC(C)C)NC(=O)CNC[C@@H](NC(=O)[C@@H](C)NC2=O)C(C)C)C=C1
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| MolPort-020-148-894 |
0.68 |
O=C(CCC1=CC=CC=C1)N1CCCCC1C(=O)N1CCOCC1
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| MolPort-046-568-283 |
0.68 |
COC1=CC=C(CCC(=O)N2C[C@@H](NC(=O)[C@@H](C)NC(=O)[C@H](CC3=CC=C(OC)C=C3)NC(=O)[C@H](CC(C)C)NC(=O)C2)C(C)C)C=C1
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CO[C@H]1C[C@H]2CN([C@@H](CC3=CC=CC=C3)C(=O)N2C1)C(=O)C1=NC=CN1C
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CC(C)C[C@@H]1NC(=O)CN(C)C(=O)[C@H](CO)NC(=O)[C@@H]2C[C@@H](CN2C(=O)[C@H](CC2=CC=CC=C2)NC1=O)NC(=O)C1=CC=CC(=C1)C(F)(F)F
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| MolPort-044-639-145 |
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CO[C@H]1C[C@H]2CN(CC3=CC=CO3)[C@@H](CC3=CC=CC=C3)C(=O)N2C1
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CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1CCC(CC1)(C(=O)N[C@@H](CC(O)=O)C(O)=O)C1=CC=CC=C1
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| MolPort-046-570-662 |
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CC[C@@H]1NC(=O)[C@H](CCCCNC(=O)[C@@H]2CCCN2C(=O)[C@@H](CC2=CC=CC=C2)NC(=O)[C@@H](NC1=O)[C@@H](C)O)NC(=O)C1=C(F)C(F)=CC=C1
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| MolPort-045-938-664 |
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COCCN1CC(=O)N[C@H](CC2=CC=C(OCC(=O)N[C@@H](CC(C)C)C1=O)C=C2)C(=O)NCC1CCOCC1
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| MolPort-046-570-573 |
0.67 |
CC(C)C[C@H]1NC(=O)CN(C[C@H]2OCC[C@H](NC(=O)[C@H](CC3=CC=CC=C3)NC(=O)[C@H](C)N(C)C1=O)[C@@H]2O)C(=O)[C@@H]1CCCO1
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| MolPort-046-567-020 |
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C[C@@H]1NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](CC2=CNC3=CC=CC=C23)NC(=O)CN(C[C@H](NC1=O)C1=CC=CC=C1)C(C)=O
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| MolPort-046-567-094 |
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C[C@H](CC(=O)N1C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](CC2=CNC3=CC=CC=C23)NC(=O)C1)C1=CC=CC=C1)C1=CC=CC=C1
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| MolPort-046-567-708 |
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C[C@@H](CC(=O)N1C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](CC2=CNC3=CC=CC=C23)NC(=O)C1)C1=CC=CC=C1)C1=CC=CC=C1
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| MolPort-046-567-476 |
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CC(C)CCC(=O)N1C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](CC2=CNC3=CC=CC=C23)NC(=O)C1)C1=CC=CC=C1
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| MolPort-046-573-199 |
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C[C@@H]1NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](CC2=CNC3=CC=CC=C23)NC(=O)CN(C[C@H](NC1=O)C1=CC=CC=C1)C(=O)CCC1=CC=CC=C1
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| MolPort-046-569-268 |
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CC(C)CC(=O)N1C[C@H](NC(=O)[C@H](C)NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](CC2=CNC3=CC=CC=C23)NC(=O)C1)C1=CC=CC=C1
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C[C@@H]1NC(=O)[C@@H]2C[C@@H](O)CN2C(=O)[C@@H](CC2=CNC3=CC=CC=C23)NC(=O)CNC[C@H](NC1=O)C1=CC=CC=C1
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| MolPort-019-669-774 |
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O=C(NCC(CC1=CC=CC=C1)NC(=O)C1CCC1)C1CCC1
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| MolPort-042-602-323 |
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CC(C(CNC(=O)CC1CC1)NC(=O)CC1CC1)C1=CC=CC=C1
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| MolPort-020-114-298 |
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OCCN(CC(=O)NCC1(CC1)C1=CC=CC=C1)C1CC1
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| MolPort-027-659-118 |
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CCC1CN(CCN1CC(C)O)C(=O)CCC1=CC2=CC=CC=C2C=C1
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CC1CC1C(=O)NCC(CC1=CC=CC=C1)NC(=O)C1CC1C
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CC(N1CCC(C1)C1=CC=CC=C1)C(=O)N1CCCCC1
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| MolPort-023-154-828 |
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CN(CC(CC1=CC=CC=C1)NC(=O)C1CCC1)C(=O)C1CCC1
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| MolPort-020-084-255 |
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CCC(CNC(=O)CN1CCN(CC(C)O)C(C)C1)C1=CC=CC=C1
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N1(C[C@@H]([C@@H](N2CCCCC2)C1)O)C(=O)C1CC2=C(C=CC=C2)C1
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NC(C(NC(C(O)=O)CC1=CC=C(O)C=C1)=O)CO.Cl
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N1(CC[C@H]([C@H](O)C1)C1=CC=C2C(C=CC=C2)=C1)C(=O)C1(CCC1)N
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O=C(NC(CC1C=CC=CC=1)CN1CCOCC1)CC1CC2NC(CC2)C1
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COC(C(NC([C@H](C(C)C)N)=O)CC1C=CC=CC=1)=O
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C(=O)(N[C@H](C(C)C)C(=O)N[C@@H](CC(C)C)C(O)=O)C1(C2C=CC=CC=2)CCN(CC1)C(=O)OC(C)(C)C
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CC1(CC2=C(C=CC=C2)C1)CNC(CN1C(=O)C(O)CCCC1)=O
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| MCULE-9676076856 |
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COC(C(NC([C@H](C(C)(C)C)N)=O)CC1C=CC=CC=1)=O
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CCC(C1C=CC(C)=CC=1)CC(NC(C(=O)O)(CC)C)=O
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OC[C@H]1[C@H](C2=CC=C(Cl)C=C2)CN(C(CN2CCOCC2)=O)C1
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C(=O)(NC(CC1=CC=CC=C1)C(O)=O)C1CCCN(C)C1
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CO[C@@H]1CN(C(CCC2=CC(OC)=CC=C2)=O)[C@H](CN2CCCC2)C1
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CCC(C1=CC=C(F)C=C1)C(N(CC(N1CC(C(O)=O)CCC1)=O)C)=O
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OCCC1NCCN(C(C2(C3=CC=CC=C3)CCCC2)=O)C1
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CC(CC(C(=O)O)CNC(CNC(CC1C=CC=CC=1)=O)=O)C
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CC(C1C=CC=CC=1F)CC(N(CC(N1CC(C(=O)O)CCC1)=O)C)=O
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N1(CC2(CCC1=O)CCN(CC2)C(=O)[C@@H](O)CC1C=CC=CC=1)CC(N)=O
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Cl.OC(C1N(CC(N2CCC(CC3C=CC=CC=3)CC2)=O)CCC1)=O
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CC(C(C(NCC(C(=O)O)(O)C)=O)NC(CC1C=CC=CC=1)=O)C
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OC([C@@H]1N(CC(NCCC2=CC=C(Cl)C=C2)=O)CCC1)=O.Cl
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OC(C1N(CC(NC(C2C=CC=CC=2)CC2C=CC=CC=2)=O)CCC1)=O
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C1(CCCN(CCCC2C=CC=CC=2)C1=O)(O)CN1CCN(CC1)C1CCCC1
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OC([C@@H]1N(CC(NCCC2=CC=C(Cl)C=C2)=O)CCC1)=O
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CN(C(C1(C2C=CC(F)=CC=2)CC1)=O)CC(N1CC(C(=O)O)CCC1)=O
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| MCULE-6254935714 |
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OC(CCC(NC(CN1C(=O)CCC1)=O)CC1C=CC=CC=1)=O
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C1(C2C=CC(=CC=2)C)(CC1)C(=O)N1C[C@H](CC2=CC=CC=C2)NC(=O)C1
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COC(C(NC(CNCC1OCCC1)=O)CC1C=CC=CC=1)=O
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C[C@@H](C(N1C[C@@H](C2C=CC=CC=2)[C@H](N)C1)=O)NC(C1CCCCC1)=O
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CC(C[C@@H](C(=O)O)NC(CNC(C1(C2C=CC=C(F)C=2)CCC1)=O)=O)C
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NC(N1[C@H](C(NC(CC2C=CC=CC=2)CCC(=O)O)=O)CCC1)=O
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| MCULE-5700574499 |
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CC1=CC=C(CCC(NCC(NCC(C2=CC=CC=C2)(C(O)=O)C)=O)=O)C=C1
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| MCULE-4976476934 |
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CCC(C(=O)O)NC(CC(C1C=CC(C)=CC=1)CC)=O
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CC(C[C@@H](C(=O)O)NC(CNC(C1(C2C=CC(C)=CC=2)CCOCC1)=O)=O)C
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CC1CCN(C([C@@H](NC(CC2=CC=C(F)C=C2)=O)CO)=O)CCC1
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| MCULE-5925678362 |
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N([C@@H](C(C)C)C(O)=O)C(=O)[C@H]1CC[C@@H](CC1)CNC(=O)[C@H](CC1C=CC=CC=1)NC(=O)OC(C)(C)C
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| MCULE-1005874633 |
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O=C([C@H](CCCNC(=N)N)NC(=O)C)NC(C(=O)N[C@H](C(=O)N[C@@](C(=O)N)(C)CC1C=CC=CC=1)CCCNC(=N)N)(C)C.O=C(C(F)(F)F)O.O=C(C(F)(F)F)O
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CC1C=CC(CCC(NCC(NC(C(=O)O)CCC=C)=O)=O)=CC=1
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CC(C(N1CC(C(N[C@@H](C(=O)O)CC2C=CC=CC=2)=O)CCC1)=O)(C)C
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OC1(C(N2CC(CC3=CC=CC=C3)NCC2)=O)COCC1
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CC(C[C@@H](C(=O)O)NC(CNC(C(CC1C=CC=CC=1Cl)C)=O)=O)C
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CC1N(CC(NCC(O)=O)=O)CC(C2=CC=C(F)C=C2)C1
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CC1=C(C2(CCOCC2)CNC(C2N(C(C3CC3)=O)CCC2)=O)C=CC=C1
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OC[C@@H](C(NC1CCCCC1)=O)NC(CC1=CC=C(F)C=C1)=O
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CCC(C1C=CC(C)=CC=1)CC(N[C@H](C(=O)O)C(C)C)=O
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N1(CCC2=CC=CC=C2)C(=O)[C@@H](NC1=O)CCC(=O)N[C@H](CO)CC1C=CC=CC=1
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C(=O)([C@H](C(C)C)N)NC[C@@]([H])(C1=CC=C(C=C1)Cl)CC(=O)N[C@@H](C(C)C)C(O)=O
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N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@H](CC1=CC=CC=C1)C2=O)C(=O)N1CCC(CC1)N1CCCCC1
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OC[C@@H]1N(C(C(CC2=C(Cl)C=CC=C2)O)=O)C[C@H]2N(CCC2)C1
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CC(C(NC(CC1=CC=CC=C1)CCC(O)=O)=O)NC(CC1CCCCC1)=O
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C1(CC2C(=CC=CC=2)C1)(N1CCN(CC1)CC)C(=O)NC(CO)CO
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| MCULE-7609539898 |
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N(C(=O)CNC(=O)CNC(=O)NC1CCCCC1)C(CC1C=CC=CC=1)C(=O)O
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N1(CC(O)N(C(=O)C1)CCC1=CC=CC=C1)C(C1CCCCC1)=O
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N1(CCNC(=O)[C@@H]1CC1C=CC=CC=1)CC(C)(C)CN1CCOCC1
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C(=O)([C@@]([H])(CC1C=CC(O)=CC=1)[NH3+])N[C@@]([H])(C)C(=O)NCC(=O)N[C@@]([H])(CC1=CC=CC=C1)C(OC)=O.[Cl-]
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CC1=C(CCNC(CN2CC(CC(N)=O)(O)CCC2)=O)C=CC=C1
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| MCULE-9954186792 |
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NCCN(C([C@@H]1NC(=O)CC1)=O)CCC1C=CC=CC=1
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[Cl-].C(=O)(C(CC1=CC=C(O)C=C1)[NH3+])N[C@@]([H])(C)C(=O)NCC(=O)NC(CC1C=CC=CC=1)C(OC)=O
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NC(C1=CC=C(CCC(N[C@H]2[C@@H](N3CC(O)CC3)CCC2)=O)C=C1)=O
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Cl.CC1N(C(C2NCCC2)=O)CC(C2=CC=C(F)C=C2)C1
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Cl.OC([C@@H]1N(CC(NCC2(C3=CC=C(F)C=C3)CCCC2)=O)CCC1)=O
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N1([C@H](CO)C[C@@H](N(C)C)C1)C(CCC1=CC=C(C=C1)F)=O
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| MCULE-3456506503 |
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CCOC(C(CC1C=CC=CC=1)CNC(C1NCCC1)=O)=O
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Cl.CC1N(C(C2NCCOC2)=O)CC(C2=CC=CC=C2)C1
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| MCULE-1472876203 |
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CCC(C1C=CC(OC)=CC=1)CC(N(C(C(=O)O)C)CCNC(=O)C)=O
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| MCULE-3906582667 |
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CC1N(C(C2NCCC2)=O)CC(C2=C(C)C=CC=C2)C1.Cl
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CC(C(N(CC(N1CC(C(=O)O)CCC1)=O)C)=O)CC1C=CC=CC=1F
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| MCULE-6689853175 |
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CC1C=CC(CCC(NCC(N[C@H]2[C@@H](C(=O)O)CCC2)=O)=O)=CC=1
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N12C[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CN(C(=O)C1CC1)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)C1=CC=CC=C1)O
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| MCULE-8049681184 |
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OC([C@@H]1N(CC(NC(C2C=CC=CC=2)CC2C=CC=CC=2)=O)CCC1)=O
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|
| MCULE-9698954426 |
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C1(=O)N(CCCC1(O)CNC1(CCCC1)C(N)=O)CCCC1C=CC=CC=1
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| MCULE-7541882311 |
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CC1=C(C2(CCOCC2)CNC(C2NC(=O)CC2)=O)C=CC=C1
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| MCULE-2766849782 |
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Cl.OC(C1N(CC(NCC2(C3C=CC(F)=CC=3)CCCC2)=O)CCC1)=O
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| MCULE-5896725877 |
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CC(N1[C@@H](C(NCC2=CC3=C(C=CC=C3)C=C2)=O)C[C@@H](O)C1)=O
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| MCULE-4595259466 |
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N12C[C@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C2=O)C1C=CC=CC=1)NC(CC(C)C)=O
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| MCULE-5120272420 |
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COC1=CC=C(C2(CC2)CNC(C2N(C3CC3)C(C([O-])=O)CC2)=O)C=C1
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|
| MCULE-6829579311 |
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CCCC(N1C(C(NC2C(C3=C(Cl)C=CC=C3)C2)=O)CCC1)=O
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|
| MCULE-4541095419 |
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CCC(C(C(N1CC(C2=CC=C(F)C=C2)(O)CC1)=O)O)(C)C
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|
| MCULE-2708924877 |
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N1C[C@H](C[C@H]1C(OC)=O)NC(CCC1=CC=C(C=C1)C)=O
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|
| MCULE-8891677370 |
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CC(C(C(N1C[C@@H](C2C=CC=CC=2)[C@H](N)C1)=O)N1CC(C)OC(C)C1)C
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|
| MCULE-9768833149 |
0.67 |
CCC(C1=CC=CC=C1)C(N1C(C)CC(O)C1)=O
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|
| MCULE-1288532919 |
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OC1C(=O)N(CC(NC2(CCC2)CC2=CC(F)=CC=C2)=O)CCCC1
|
|
| MCULE-6612741572 |
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C(=O)([C@H](C(C)C)N)NC[C@@]([H])(C1=CC=C(C=C1)Cl)CC(=O)N[C@@H](C(C)C)C(O)=O.Cl
|
|
| MCULE-5292855513 |
0.67 |
CN(C(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O)C
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|
| MCULE-6391737403 |
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C1C=CC(CCCN2[C@H]([C@@H]([C@](O)(CC2)C)NC(C2CCCC2)=O)C2C=CC=CC=2)=CC=1
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|
| MCULE-5648171051 |
0.67 |
FC1=C(C2C(NC(C3NC(=O)CC3)=O)C2)C=CC=C1
|
|
| MCULE-1119601515 |
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O=C(N1[C@@H]2[C@@H](OCC2)C[C@H]1C(NC1CC1)=O)CC1CC(C2=CC=CC=C2)C1
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|
| MCULE-9527931903 |
0.67 |
N1(C[C@@H](C[C@H]1C(O)=O)N(C)C)C(=O)CC1=CC=C(C=C1)C(F)(F)F
|
|
| MCULE-6730234371 |
0.67 |
CCCC(C(NC(C(=O)O)COC)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-2890303299 |
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CC([C@@H](C(NCC(N1C(CC2C=CC=CC=2)CCC1)=O)=O)N)C
|
|
| MCULE-5328230286 |
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OC([C@H](NC(CN1C(=O)C2(CCCC2)NC1=O)=O)CC1C=CC=CC=1)=O
|
|
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0.67 |
N1(CCC2C=CC(=CC=2)Cl)C(=O)CCC1(C)C(NCCCOC)=O
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CC(C(N1CC(CCO)NCC1)=O)CC1=CC=C(F)C=C1
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N1C[C@@H](C[C@H]1C(OC)=O)NC(CCC1=CC=C(C=C1)C)=O
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CN(C1[C@H](O)CN(C(CC2=CC(C)=CC=C2)=O)C1)CC(O)=O
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O=C([C@H](CC1C=CC=CC=1)NC(=O)[C@H](CC1C=CC=CC=1)NC(=O)OC(C)(C)C)O
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C1(O)(C(F)(F)F)C(=O)NC(C(=O)N1)CC1C=CC=CC=1
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N1(C[C@@H]([C@@H](N2CCCC2)C1)O)C(=O)C(C1C=CC=CC=1)=O
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O=C(C(F)(F)F)O.O=C(C(F)(F)F)O.O=C(C[C@@H]1NC(=O)CNC(=O)[C@H](CCCNC(=N)N)NC(=O)[C@H](CCCCN)NC(=O)[C@@H](CC2C=CC(O)=CC=2)NC1=O)O
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CC1CN(C(C(NC(C2C=CC=CC=2)=O)CC2C=CC=CC=2)=O)CC(C(=O)O)C1
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OC(C1=C(F)C=CC=C1)CNC(CN1C(=O)CCCC1)=O
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C12(CCN(CC1)C(C)=O)OC1C=CC(=CC=1)OCCNC([C@H](C)NC(=O)[C@H](CC1=CC=CC=C1)NC(=O)[C@H](C)NC2=O)=O
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O[C@H]1C[C@H](C(N2CCC3(C4=C(C=CC=C4)CO3)CC2)=O)NC1
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CC1C=CC(CCC(NCC(NC2(CCCC2)CC(=O)O)=O)=O)=CC=1
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COCCC1CCN(C(C2C(C3=CC=CC=C3)CCCN2)=O)CC1
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CC1=C(C2(CCOCC2)CNC([C@@H]2N[C@H](C(O)=O)CC2)=O)C=CC=C1
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N1(C[C@H](CC)NC(=O)[C@H](CC2C=CC=CC=2)NC([C@H](CC(C)C)NC(=O)[C@@H](C)NC(=O)C1)=O)C(C1CC=CC1)=O
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C(=O)(OC(C)(C)C)N1CCC(CC1)(C1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC(C)C)C(O)=O
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CN1C(C(N2CCC3(C4C=CC=CC=4CO3)CC2)=O)(C)CC(O)C1
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CC1C=CC(CCC(NCC(NCC(C2C=CC=CC=2)C(=O)O)=O)=O)=CC=1
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C=CC(N1CCC(C(NC(C(N2CCCC2)=O)CC2=CC=CC=C2)=O)CC1)=O
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OC(C1CN(C(C(NC(C2C=CC=CC=2)=O)CC2C=CC=CC=2)=O)CCC1)=O
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CC(C1CNCCC1)CC(NC(CC1C=CC=CC=1)CN1CCOCC1)=O
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C1(CCCC1)(N1CCCC1)C(=O)NCC(O)C1=CC=C(C=C1)C
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C(=O)(OC(C)(C)C)N1CCC(CC1)(C1C=CC=CC=1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](C(C)C)C(O)=O
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N1(C[C@@H]([C@@H](C2=CC=CC=C2)C1)N(C)C)C(=O)C1(CCC1)COC
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N1(C[C@H](C[C@@H]1C(NCCOC)=O)OC1C=CC=CC=1)C(=O)CC1=CC=CC(C)=C1
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C1(=O)[C@H](CC(C)C)NC(COC2C=CC(=CC=2)C[C@H](NC(=O)CN1CCOC)C(=O)NC1CCC1)=O
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OCC(NC(C1N(C2CCCC2)CC1)=O)CC1=CC=C(F)C=C1
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CN(C(C(N1CC(NC(C2CCC2)=O)C1)=O)CC1=CC=CC=C1)C
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N12C[C@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CO)C2=O)C1C=CC=CC=1)N
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CCC(C1C=CC(C)=CC=1)CC(N1C(C(=O)O)CC(OC)C1)=O
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OC([C@H]1N(CC(NCCC2C=CC(Cl)=CC=2)=O)CCC1)=O
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CN1CC(CNC([C@@H]2N(C(C)=O)C[C@H](O)C2)=O)N(CC2=CC=CC=C2)CC1
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CCN(C(C=C)=O)CC(N1CC(C2=CC=C(F)C=C2)(O)CC1)=O
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C1(=O)[C@H](CC(C)C)NC(COC2C=CC(=CC=2)C[C@H](NC(=O)CN1CCOC)C(=O)NC1CC1)=O
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CN1C(=O)N(CCCC(N[C@@H](C(O)=O)CC2=CC=CC=C2)=O)C(=O)C1
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CC(C(C(N1CC(C2=CC=CC=C2)(CO)CC1)=O)O)(O)C
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CCC1C=CC(CCC(N2C(C(=O)O)CC(OC)C2)=O)=CC=1
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O=C(NC1CCN(C(CCC2=CC=CC=C2)=O)CC1)CN1CC(C2=CC=CC=C2)CC1
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N12C[C@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CO)C2=O)C1C=CC=CC=1)N
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N1(CCC(O)(C2C=CC=CC=2C)C1)C(=O)CN1CCCN(C)CC1
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N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@H](CC1C=CC=CC=1)C2=O)C(=O)NC1CCN(CC1)C
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NC(NC(C(NC1C2OC(CC2)C1)=O)CC1=CC=CC=C1)=O
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N[C@H]1[C@H](C2C=CC=CC=2)CN(C(CNCC2OCCC2)=O)C1
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| MCULE-3573179460 |
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FC1=CC=C(C2(CC2)CNC([C@@H]2NC(=O)CC2)=O)C=C1
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N1(CCC[C@H]1C(O)=O)C(=O)[C@H]1CC[C@@H](CC1)CNC(=O)[C@H](CC1C=CC=CC=1)NC(=O)OC(C)(C)C
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N1[C@H](C(C)C)C(=O)NCCCN(CCCC(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@H](C)C1=O)C(COC)=O
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OC([C@H]1[C@@H](C2=CC=CC=C2)CN(C(C2CCC2)=O)C1)=O
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C1(C2=CC=CC=C2C)(CC(=O)N2CCC[C@H]2C(OC)=O)CC(N(CCN(C)C)C1=O)=O
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OC([C@H](NC(CCCN1C(=O)NCC1=O)=O)CC1C=CC=CC=1)=O
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| MCULE-4433501575 |
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C1(=O)CN(CCN1CCC1C=CC=CC=1)CC1(CNCC1)O
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| MCULE-5543019911 |
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N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)OCC(=O)N[C@H](CC1C=CC=CC=1)C2=O)C(=O)N1CCC(CC1)(F)F
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CN1C(=O)N(CCCC(N[C@@H](C(=O)O)CC2C=CC=CC=2)=O)C(=O)C1
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| MCULE-7383111812 |
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CNC(C1N(C(CC(C2=CC=C(Cl)C=C2)(C(O)=O)C)=O)CCC1)=O
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N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)OCC(=O)N[C@@H](C(C)C)C2=O)C(=O)N1CCC(CC1)(F)F
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CN(C(CCC1C=CC(C)=CC=1C)=O)CC(N1CC(C(=O)O)CCC1)=O
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N12C[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CN(C(C1CCC1)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)C1C=CC=CC=1)O
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C(=O)([C@H](CC1C=CC=CC=1)NC(=O)OC(C)(C)C)N1CCC(CC1)C(=O)N[C@H](C(O)=O)CC(O)=O
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OC1CN(C(CCC2=CC(F)=C(F)C=C2)=O)C(C(O)=O)C1
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| MCULE-2501502558 |
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CC1=C(C2(CCOCC2)CNC([C@@H]2NC(=O)CC2)=O)C=CC=C1
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N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)OCC(=O)N[C@H](CC1=CC=CC=C1)C2=O)C(=O)N1CC[C@@H](C1)NC(C)=O
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CC(CC(NC(C1C=CC=CC=1)C(NC(C(=O)O)CC1C=CC=CC=1)=O)=O)C
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CC(C(N1CC(CC2=CC=CC=C2)NCC1)=O)(N1CCOCC1)C
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N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@H](CC1=CC=CC=C1)C2=O)C(=O)N1CCC(CC1)C(N)=O
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COC1CN(C(CCC2C=CC(CC(C)C)=CC=2)=O)C(C(=O)O)C1
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CCC1C=CC=C(CC(NCC(N[C@H](C(=O)O)CC(C)C)=O)=O)C=1
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N1(C[C@H](C[C@H]1C(=O)NC1CC1)OC1=CC=CC=C1)C(=O)CC1C=CC=CC=1
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COC1CN(C(CCC2C=CC(C(C)(C)C)=CC=2)=O)C(C(=O)O)C1
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O=C(N1[C@@H]2[C@@H](OCC2)C[C@H]1C(NC1CC1)=O)CCCC1=CC=CC=C1
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C(=O)(OC(C)(C)C)N1CCC(CC1)(C1C=CC=CC=1)C(=O)N[C@@H](C)C(=O)N[C@H](C(O)=O)CC(O)=O
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CN(C(CCC1C=CC(Cl)=CC=1)=O)CC(N1CC(C(=O)O)CCC1)=O
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| MCULE-4971919978 |
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CNC(C1(N(C(CCC2=C(F)C=C(F)C=C2)=O)CCC1)COC)=O
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| MCULE-9963603319 |
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CC1=C(CNC(C2N(C(CC3=C(F)C=CC=C3)=O)CC(O)C2)=O)C(C)=CC=C1
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CN1C(=O)N(CCCC(N[C@H](C(O)=O)CC2=CC=CC=C2)=O)C(=O)C1
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CN(C(C1(C2C=CC=CC=2)CCOCC1)=O)CC(N1CC(C(=O)O)CCC1)=O
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N1(CCC[C@H]1C(=O)N1CCC(CC1)(C1=CC=CC=C1)C(=O)N[C@@H](CC1C=CC=CC=1)C(O)=O)C(=O)OC(C)(C)C
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O=C(C(C1=CC=CC=C1)C1=CC=CC=C1)N[C@H](C(N1CCOCC1)=O)CC1=CC=CC=C1
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C1(C[C@@H](NC(=O)CCC)C(NCCCCCCCNCCCCN)=O)=CC=C(O)C=C1.Cl.Cl
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OC1CN(C(CC2=C(F)C=CC=C2)=O)C(C(NC2C3C(OCC3)CCC2)=O)C1
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N1C2(CCCC2)C(=O)N[C@@H](CC2=CC=C(C=C2)OC)C1=O
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| MCULE-3294870103 |
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OC(CNC(CN1C(CC2C=CC=CC=2)CCC1)=O)=O
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C1(=O)[C@H](CC(C)C)NC(COC2=CC=C(C=C2)C[C@@H](C(=O)NCC2CCOCC2)NC(=O)CN1CCOC)=O
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N1(CC(OC)CC1C(OC)=O)C(CCC1C=CC=CC=1)=O
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| MCULE-5329424648 |
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CC(C(N1C(C(O)=O)CCC(C(O)=O)C1)=O)CC1=CC=CC=C1
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| MCULE-5007155714 |
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N1(CCC[C@H]1C(=O)N1CCC(CC1)(C1=CC=CC=C1)C(=O)N[C@H](C(O)=O)CC(O)=O)C(=O)OC(C)(C)C
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COC1CN(C(CCC2C=CC(C)=CC=2)=O)C(C(=O)O)C1
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C(=O)(N(C)C)CN1CC[C@H]([C@H](O)C1)NC(CCC1=CC=CC(Cl)=C1)=O
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C1(=O)[C@H](CC(C)C)NC(COC2=CC=C(C=C2)C[C@H](C(=O)NCC2CCOCC2)NC(=O)CN1CCOC)=O
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COC(C1(CC1)CNC(C(NC(C)=O)CC1=CC=C(O)C=C1)=O)=O
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| MCULE-2815029672 |
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CCC(C(N1CC(C(NC(C(=O)O)CC2C=CC=CC=2)=O)CCC1)=O)C
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N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@@H](CC(C)C)C(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC(=O)C1C=CC=C(C=1)C(F)(F)F
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N1(CCC2=CC=C(C=C2)SC)C(=O)CCC1(C)C(NCCCOC)=O
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C(=O)(C1(C2=CC=CC=C2)CCN(CC1)C)N1CC[C@@]([C@H](O)C1)(CC)O
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N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)C1C=CC=C(F)C=1F)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
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COC1CN(C(CCC2C=CC(C(C)C)=CC=2)=O)C(C(=O)O)C1
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N1(C[C@@H](C[C@H]1C(O)=O)O)CC(NCCC1=CC=C(C=C1)OC)=O
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N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N[C@H]2CCO[C@@H]([C@H]2O)CN(C(=O)[C@@H]2CCCO2)CC(=O)N[C@H](CC(C)C)C1=O
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CO[C@@H]1CN(C)[C@H](C(NCCC2CC3=C(C=CC=C3)C2)=O)C1
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| MCULE-1492037958 |
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CCCCC(C(O)=O)NC(C(N1CCC(CC2=CC=CC=C2)CC1)C)=O
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| MCULE-3601108262 |
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N1(C)[C@@H](C)C(=O)N[C@@H](CC2C=CC=CC=2)C(=O)N[C@H]2CCO[C@@H]([C@H]2O)CN(C(=O)[C@H]2CCCO2)CC(=O)N[C@H](CC(C)C)C1=O
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CCC1C=CC(C(CC(N2C(C(=O)O)CC(OC)C2)=O)C)=CC=1
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| MCULE-1981114676 |
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NCCN(C([C@H]1NC(=O)CC1)=O)CCC1C=CC=CC=1
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| MCULE-1046941984 |
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N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)CC1=CC=CS1)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1C=CC=CC=1)C2=O)=O
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COC1CN(C(C(CC2C=CC(C)=CC=2)C)=O)C(C(=O)O)C1
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| MCULE-5490161919 |
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N([C@H](C(C)C)C(O)=O)C(=O)[C@H]1CC[C@@H](CC1)CNC(=O)[C@H](CC1C=CC=CC=1)NC(=O)OC(C)(C)C
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| MCULE-5514862675 |
0.67 |
N1(CC(=O)N[C@H](CC(C)C)C(=O)N(C)[C@@H](C)C(N[C@@H](CC2C=CC=CC=2)C(=O)N[C@H]2CCO[C@@H]([C@H]2O)C1)=O)C(=O)[C@@H]1CCCN2CCCC[C@]12[H]
|
|
| MCULE-2146365462 |
0.67 |
C(=O)(C(CC1=CC=CC=C1)NC(C1C=CC=CC=1)=O)NC(C)C(O)=O
|
|
| MCULE-6412472848 |
0.67 |
COC1C(=O)N(CC(N2CC(C3=CC=CC=C3)(O)C2)=O)CCCC1
|
|
| MCULE-9678780949 |
0.67 |
N1(C[C@@H]2C[C@@H](CN2C(=O)[C@@H]1CC1C=CC=CC=1)OC)C(=O)C1=NC=CN1C
|
|
| MCULE-6584083919 |
0.67 |
COC1CN(C(CC(C2C=CC(C(C)C)=CC=2)C)=O)C(C(=O)O)C1
|
|
| MCULE-2496040522 |
0.67 |
CC1=CC(C2CCN(C([C@H]3N(C(N)=O)CCC3)=O)CC2)=CC(C)=C1
|
|
| MCULE-7356132443 |
0.67 |
N12C[C@H](C[C@H]1CN([C@@H](CC1C=CC=CC=1)C2=O)CC1=CC=CO1)OC
|
|
| MCULE-6053723756 |
0.67 |
N1[C@H](C(C)C)C(=O)N[C@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N(CC(=O)NCCC[C@@H](C1=O)NC(=O)CCN1CCCCCC1=O)C
|
|
| MCULE-5660165994 |
0.67 |
CC(C1C=CC=C(F)C=1)CC(N(C(C(=O)O)C)CCNC(=O)C)=O
|
|
| MCULE-4684957389 |
0.67 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CN(C(=O)C[C@H](C)C1C=CC=CC=1)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)C1C=CC=CC=1)O
|
|
| MCULE-4157513792 |
0.67 |
CCC(C(=O)O)NC(C(C1C=CC=CC=1)N1C(=O)CCCC1)=O
|
|
| MCULE-2030779181 |
0.67 |
CCC(C(NC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O)C)C
|
|
| MCULE-2402294115 |
0.67 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CN(C(=O)CC(C)C)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)C1C=CC=CC=1)O
|
|
| MCULE-1100004209 |
0.67 |
CN1C(=O)N(CCCC(NC(C(=O)O)CC2C=CC=CC=2)=O)C(=O)C1
|
|
| MCULE-5338757680 |
0.67 |
N(C(CCC1=CC(C)=CC(C)=C1)=O)[C@@H]1CNC[C@H]1O
|
|
| MCULE-2900621974 |
0.67 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CN(C(=O)C[C@@H](C)C1=CC=CC=C1)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)C1C=CC=CC=1)O
|
|
| MCULE-7117099818 |
0.67 |
C1(C2=CC=C(C=C2)C2=CC=CC=C2)(CC(=O)N2CCNC(=O)C2CC)CC(N(C)C1=O)=O
|
|
| MCULE-2063634287 |
0.67 |
C1C=C(C[C@H](NC(CC[C@H](N)C(=O)O)=O)C(=O)O)C=CC=1
|
|
| MCULE-9475289682 |
0.67 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CN(C(CCC1=CC=CC=C1)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)C1=CC=CC=C1)O
|
|
| MCULE-6122074454 |
0.67 |
COC1(OC)C(O)CN(C(CNC(CC2=CC(F)=CC=C2)=O)=O)CC1
|
|
| MCULE-1046181459 |
0.67 |
O=C(N1C(CC2=CC=CC=C2)CCCC1)C1NC(=O)CC1
|
|
| MCULE-3072928063 |
0.67 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CN(C(C)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)C1=CC=CC=C1)O
|
|
| MCULE-7088727262 |
0.67 |
Cl.OC1CC(C(NCCC2=CC=C(OC(F)(F)F)C=C2)=O)NC1
|
|
| MCULE-4961569990 |
0.67 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](CC1C=CC=CC=1)C(=O)NCCN(C(C1CCOCC1)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)O
|
|
| MCULE-8664433494 |
0.67 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CN(C(CCC(C)C)=O)CC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)C1C=CC=CC=1)O
|
|
| MCULE-7974262321 |
0.67 |
[C@H]1(CN(C[C@H]1C1=CC=CC(F)=C1)CC(=O)NC1CCCCC1)C(O)=O
|
|
| MCULE-7191660875 |
0.67 |
OC(C1(NC(CNC(CC2=C3C(C=CC=C3)=CC=C2)=O)=O)CCCCCC1)=O
|
|
| MCULE-8464230260 |
0.67 |
N12C[C@@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CNCC(=O)N[C@H](CC1C3C=CC=CC=3NC=1)C2=O)C1C=CC=CC=1)O
|
|
| MCULE-9573324857 |
0.67 |
C1(C(NCCCOC)=O)(CC2C(=CC=CC=2)C1)N1C[C@@H](C)O[C@@H](C)C1
|
|
| MCULE-1658217573 |
0.67 |
N1(CC(O)=O)CC(CC1=O)C1C=CC=CC=1
|
|
| MCULE-4767099441 |
0.67 |
CN(C(C1CCC1)=O)CC(NC(C1CCC1)=O)CC1=CC=CC=C1
|
|
| MCULE-9422422248 |
0.67 |
N12C[C@@H](C[C@H]1C(=O)N[C@H](C(C)C)CC[C@@H](C)CC(=O)N[C@@H](CC1C=CC(=CC=1)O)C(=O)NCCCC2=O)N
|
|
| MCULE-3274346523 |
0.67 |
N1(C[C@H]([C@H](C(O)=O)C1)C1C=CC=CC=1)C(C1CCC1)=O
|
|
| MCULE-7701430289 |
0.67 |
CCC(C(C(NCC(C1C=CC=CC=1)CCO)=O)N)C
|
|
| MCULE-6202023001 |
0.67 |
CC1(C2C(CCO2)C1NC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O)C
|
|
| MCULE-6411150448 |
0.67 |
[O-]C(C1N(C2CC2)C(C(NCCCC2=CC(F)=CC(F)=C2)=O)CC1)=O.[Na+]
|
|
| MCULE-6752186951 |
0.67 |
N1(CC2CC2)CC(=O)N[C@@H](CC(C)C)COC2C=CC(C[C@@H](C(=O)N[C@@H](CC3C=CC(=CC=3)OC)C(=O)N[C@H](C)C1=O)NC(=O)[C@H]1CCC(=O)N1)=CC=2
|
|
| MCULE-3431190485 |
0.67 |
CC([C@@H](C(=O)O)NC(CN(C(=O)C)CCC1C=CC=CC=1)=O)C
|
|
| MCULE-4077365676 |
0.67 |
COC1=CC=C(CCC(N2CC(N(CC(O)=O)C)[C@H](O)C2)=O)C=C1
|
|
| MCULE-5503037174 |
0.67 |
C(=O)(C1CCCCC1C(O)=O)NC(CC1=CC=CC=C1)C(O)=O
|
|
| MCULE-2227474563 |
0.67 |
N1(C[C@H](C[C@H]1C(=O)N1CCOCC1)OC1C=CC=CC=1)C(=O)C1(C2=CC=CC=C2)CC1
|
|
| MCULE-9370184322 |
0.67 |
CCCC(C(NCC(C1C=CC=CC=1)CCO)=O)(N)C
|
|
| MCULE-2258031544 |
0.67 |
CO[C@H]1C[C@@H](C(NCCC2=C(C)C=C(F)C=C2)=O)NC1
|
|
| MCULE-7816204859 |
0.67 |
N12C[C@@H](CC1C(=O)N[C@@H](C)C(=O)N[C@@H]1CCC[C@H]1C(N[C@@H](CC(C)C)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)=O)NC(=O)C1=CC=C(C=C1)CN(C)C
|
|
| MCULE-7431854180 |
0.67 |
N1(C[C@H](C[C@H]1C(=O)N(C)C)OC1CCN(CC1)C)C(=O)C1(C2C=CC(=CC=2)OC)CC1
|
|
| MCULE-5706844383 |
0.67 |
CCC1N(CC(O)C)CCN(C(CCC2=CC3=C(C=CC=C3)C=C2)=O)C1
|
|
| MCULE-7156396799 |
0.67 |
O=C(NC(C(NC1CC1)=O)CC1=CC=CC=C1)COC1CCCC1
|
|
| MCULE-9958824699 |
0.67 |
COCC(CC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)C
|
|
| MCULE-3842242485 |
0.67 |
O[C@H]1[C@@H](C[C@](C(=O)N[C@H](C(N)=O)CC2C=CC(=CC=2)OC)(C[C@@H]1NC(CC1(CC(O)=O)CCCC1)=O)O)O
|
|
| MCULE-8649001973 |
0.67 |
CC(C(N1CC(CO)(O)CC1)=O)(CC1=CC=CC=C1)C
|
|
| MCULE-5387231237 |
0.67 |
C1C=CC(CCCN2[C@H]([C@@H]([C@](O)(CC2)C)NC(C2CC2)=O)C2C=CC=CC=2)=CC=1
|
|
| MCULE-6887603324 |
0.67 |
N1(CCCNC(=O)[C@H](CC2C=CC=CC=2)NC(CN(C)C(=O)[C@H](C(C)C)NC(=O)[C@H]1C)=O)C(C(C)C)=O
|
|
| MCULE-4368498341 |
0.67 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](CO)C(=O)N(C)CC(=O)N[C@H](C(C)C)C(=O)N[C@@H](CC1=CC=CC=C1)C2=O)NC(CCC1C=NN(C)C=1)=O
|
|
| MCULE-8536399468 |
0.67 |
NC(C(N1CCN(CCO)CC1)=O)CC1C=CC=CC=1
|
|
| MCULE-9865102607 |
0.67 |
CN1C(C(N2CCC(C3=C4C(C=CC=C4)=NC=C3)CC2)=O)(C)CC(O)C1
|
|
| MCULE-3630116318 |
0.67 |
CCC1(C(NC(C(=O)O)CC2C=CC=CC=2)=O)CC1
|
|
| MCULE-3013597659 |
0.67 |
C1(=O)[C@@H]2CCCN2C(=O)CN(CC2C=CC=CC=2)C[C@H]2OCC[C@@H]([C@@H]2O)NC(=O)[C@H](CC2C=CC=CC=2)NC(=O)[C@H](C)N1C
|
|
| MCULE-3223155066 |
0.67 |
CC(C(N1CCCCC1)=O)N1CC(C2=CC=CC=C2)CC1
|
|
| MCULE-9600721566 |
0.67 |
C1(CC2C(=CC=CC=2)C1)(N(C)CC1=CC=CC=C1)C(=O)N1CCCC(O)C1
|
|
| MCULE-4327583827 |
0.67 |
OC([C@H]1N[C@@H](C(NCC2(C3=C(F)C=C(F)C=C3)CC2)=O)CC1)=O
|
|
| MCULE-4577297642 |
0.67 |
N12CCC[C@@H]1C(=O)N[C@H](CC(C)C)C(=O)N[C@H]1CCO[C@@H]([C@H]1O)CN(CC1C=CC=CC=1)CC(=O)N[C@@H](CC1C=CC=CC=1)C2=O
|
|
| MCULE-6785930105 |
0.67 |
CCC(C(C(NCC(N(CC)CC)CC1C=CC=CC=1)=O)N)C
|
|
| MCULE-3329021019 |
0.67 |
N12C[C@H](C[C@H]1C(=O)N[C@@H](C)C(=O)N[C@H]1CCC[C@@H]1C(=O)N[C@H](C(C)C)C(=O)N[C@@H]([C@@H](C)O)C2=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-9995932262 |
0.67 |
CC(C[C@@H](C(=O)O)NC(CNC(C1(CC1)CC1C=CC=CC=1F)=O)=O)C
|
|
| MCULE-6278617446 |
0.67 |
N12C[C@H](C[C@H]1C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@@H](C)C(=O)NCCC1C=CC(=CC=1)OCC(=O)N[C@@H](CC1C=CC=CC=1)C2=O)NC(C1CCOCC1)=O
|
|
| MCULE-6020465452 |
0.67 |
CC(C(C(O)=O)NC(CN(C(C)=O)CCC1=CC=CC=C1)=O)C
|
|
| MCULE-3021704219 |
0.67 |
CC(C(=O)O)(CNC(C(NC(C1C=CC=CC=1)=O)CC1C=CC=CC=1)=O)O
|
|
| MCULE-5252680078 |
0.67 |
CN(C(C(CC1C=CC=CC=1)N)=O)C1COCC1
|
|
| MCULE-8505486402 |
0.67 |
CCC(C(N(C(C(=O)O)CC1C=CC=CC=1)C)=O)CC
|
|
| MCULE-8280660613 |
0.67 |
O=C(C1CCC1)NCC(NC(C1CCC1)=O)CC1=CC=CC=C1
|
|
| MCULE-3336717830 |
0.67 |
N1(C)C[C@H](C[C@H]1C(O)=O)NC(CCC1C=CC(=CC=1)OC)=O
|
|
| MCULE-3182644944 |
0.67 |
N1C(=O)[C@@H](C)NC(=O)[C@H](CC2C=CC(OC[C@H](CC3=CC=CC=C3)NC(=O)[C@@H](C(C)C)NC(=O)[C@@H]1[C@@H](C)O)=CC=2)NC(C(C)C)=O
|
|
| MCULE-1314453219 |
0.67 |
CC(C1=CC=C(CC(NC(C2NCCC2)=O)C)C=C1)C
|
|
| MCULE-4498589241 |
0.67 |
CC1=CC(CCC(NCC2NCCC2)=O)=CC=C1
|
|
| MCULE-6006340460 |
0.67 |
CN1C(C(NCC(C2=CC(F)=C(Cl)C=C2)O)=O)(C)CC(O)C1
|
|
| MCULE-2073325325 |
0.67 |
OC(C1CN(C(CNC(CC2C=CC=C3C=2C=CC=C3)=O)=O)CCC1)=O
|
|
| MCULE-6271430309 |
0.67 |
COCCCNC(CN1CC(C2=CC=CC=C2)CC1)=O
|
|
| MCULE-2415410925 |
0.67 |
CCC(C(=O)O)(NC(CN(C(=O)C)CCC1C=CC=CC=1)=O)C
|
|
| MCULE-5750937019 |
0.67 |
N1(C)C[C@@H](C[C@H]1C(O)=O)NC(CCC1=CC=C(C=C1)N(C)C)=O
|
|
| MCULE-5190113678 |
0.67 |
C1(C)(C)C(C1(C)C)C(=O)N1CC(=O)N[C@H](CC2C3C=CC=CC=3NC=2)C(=O)N2C[C@@H](C[C@H]2C(=O)N[C@@H](C)C(=O)N[C@H](C2=CC=CC=C2)C1)O
|
|
| MCULE-3405998624 |
0.67 |
C(C1C=CC=CC=1)C(N)C(=O)NC(C(=O)N)CC(C)C.Br
|
|
| MCULE-1813558056 |
0.67 |
CCC(C1=CC=CC=C1)CNC(CN1CC(C)N(CC(O)C)CC1)=O
|
|
| MCULE-2133432890 |
0.67 |
CC(OC1=CC(C(CNC(C2(N(C)CC(O)C2)C)=O)O)=CC=C1)C
|
|
| MCULE-2049248682 |
0.67 |
C(O)(=O)C(F)(F)F.C(O)(=O)C(F)(F)F.C(C1C=CC(O)=CC=1)[C@H]1NC([C@@H](NC(CNC(=O)[C@H](CCCNC(N)=N)NC(=O)[C@H](CCCCN)NC1=O)=O)CC(=O)O)=O
|
|
| MCULE-2592777504 |
0.67 |
CC(C1=CC=CC=C1)(CNC(C1NC(=O)CC1)=O)C
|
|
| MCULE-1962905125 |
0.67 |
CCCC(C(NCC(N(CC)CC)CC1C=CC=CC=1)=O)N
|
|
| MCULE-2760121051 |
0.67 |
CO[C@@H]1CN(C(CC2=C(C(F)(F)F)C=CC=C2)=O)[C@H](C(N)=O)C1
|
|
| MCULE-1265415447 |
0.67 |
O=C(C1NCCC1)NCCCC1C=CC=CC=1
|
|
| MCULE-1817658784 |
0.67 |
CCC(C(NC(C(=O)O)CC1C=CC=CC=1)=O)CC
|
|
| MCULE-6278675940 |
0.67 |
CCN(C(CC1C=CC=CC=1)CNC([C@H](CC(C)C)N)=O)CC
|
|
| MCULE-4980262359 |
0.67 |
C(=O)(OC(C)(C)C)N[C@@H](CC1=CC=CC=C1)C(=O)NC[C@@H]1CC[C@H](CC1)C(=O)N[C@@H](CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-1589802428 |
0.67 |
C1(CCCCC(=O)N1)(CC1C=CC=CC=1)C(NCCCN1CCOCC1)=O
|
|
| MCULE-4210864600 |
0.67 |
OC1CCN(CC(NCC2(C3=CC=CC=C3)CC2)=O)CC1
|
|
| MCULE-7706938642 |
0.67 |
CC([C@H](C(=O)O)NC(CN(C(=O)C)CCC1C=CC=CC=1)=O)C
|
|
| MCULE-9152061770 |
0.67 |
CO[C@H]1C[C@H](C(NCC2(C3=C(F)C=CC=C3F)CCCC2)=O)NC1
|
|
| MCULE-9681135208 |
0.67 |
OC1C(N2CCN(C(CCC3=CC=CC=C3)=O)CC2)CCC1
|
|
| MCULE-3466926951 |
0.67 |
CCC(C(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)CC
|
|
| MCULE-1817159933 |
0.67 |
CCCC(C(NC(CC1=CC=CC=C1)CN(C)C)=O)N
|
|
| MCULE-3400467237 |
0.67 |
C1(=O)[C@H](CC(C)C)NC(COC2=CC=C(C=C2)C[C@@H](C(=O)NCC(=O)N(C)C)NC(=O)CN1CCOC)=O
|
|
| MCULE-6618779420 |
0.67 |
CC([C@@H](C(NCC(N1C(C)CC(C2C=CC=CC=2C)C1)=O)=O)N)C
|
|
| MCULE-3048566881 |
0.67 |
CC(NCC(N1CC(C2=CC(C)=CC(C)=C2)CC1)=O)=O
|
|
| MCULE-5690281397 |
0.67 |
CC1C(C(NCC(NC(C2C(C)C2)=O)CC2=CC=CC=C2)=O)C1
|
|
| MCULE-3228565667 |
0.67 |
CC([C@H]1[C@@H](C(N2C(CC3=CC=CC=C3)C(=O)NCCC2)=O)OCC1)C
|
|
| MCULE-2185312092 |
0.67 |
C(=O)(C(CC1=CC=CC=C1)NC(CNC(CNC(=O)OC(C)(C)C)=O)=O)NC(CC(C)C)C(=O)NC(CCCNC(N)=N)C(O)=O
|
|
| MCULE-6404863799 |
0.67 |
CCC(NC(C1NCCC1)=O)CC1C=CC=CC=1
|
|
| MCULE-6990406692 |
0.67 |
CC(C1=CC=CC=C1)C(NC(CC1CC1)=O)CNC(CC1CC1)=O
|
|
| MCULE-8289080072 |
0.67 |
CC(N1[C@@H](C(NC2(C3=CC(C(F)(F)F)=CC=C3)CCC2)=O)C[C@@H](O)C1)=O
|
|
| MCULE-5188155149 |
0.67 |
CC1C=CC(CCC(NCC(N2C(CN)CCC2)=O)=O)=CC=1
|
|
| MCULE-6099428837 |
0.67 |
CC(NCC(N1C(C)(C)CC(C2=CC=CC=C2)C1)=O)=O
|
|
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0.67 |
CCC(C(O)=O)NC(CN(C(C)=O)CCC1=CC=CC=C1)=O
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0.67 |
C(=O)(OC(C)(C)C)N1CCC[C@H]1C(=O)NC[C@H]1CC[C@@H](CC1)C(=O)N[C@@H](CC1C=CC=CC=1)C(O)=O
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N1(C)CC2(CCC1=O)CCN(CC2)C(=O)CN1CCC(C2=CC=CC=C2)C1
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0.67 |
CC[C@@H]([C@@H](C(N(C)C)=O)NC(CCC1=CC=C(CC)C=C1)=O)C
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N1(CCCCNC(=O)[C@@H](C)NC(=O)[C@@H](NC(=O)[C@@H](CC2C=CC=CC=2)NC(=O)C2=CC=C(C=C2)C1)CC(C)C)C(=O)C1(O)CCN(CC1)C
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Cl.OC(C1N(CC(NCCC2C=CC(Cl)=CC=2)=O)CCC1)=O
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CCC(C1C=CC=CC=1)CC(NC1(C(=O)O)CC1)=O
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NC(C(N1CCN(CC(N2CCCC2)=O)CC1)=O)CC1C=CC=CC=1
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CO[C@@H]1CN(C(CCC2=CC(F)=C(OC)C=C2)=O)[C@H](C(N)=O)C1
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CC1C2(C(=O)N(CC(N[C@@H](C(=O)O)CC3C=CC=CC=3)=O)C(=O)N2)CCCC1
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CC(C(C1C=CC=CC=1)CC(NC1(C(=O)O)CC1)=O)C
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CCCC(C(NCC(N(CC)CC)CC1C=CC=CC=1)=O)(N)C
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N1(C[C@H](C[C@H]1C(N)=O)OC1=CC=CC=C1)C(CCC1C=CC(=CC=1)OC)=O
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CN1C2(CCCCC2)C(=O)N(CC(NC(C(=O)O)CC2C=CC=CC=2)=O)C1=O
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N1(CCN(C(=O)C1)CCC1=CC=CC=C1)C(=O)CN1CCCCC1=O
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CNCC1N(C(CCC2C=CC=C(C)C=2)=O)CCC1
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N1(CC(=O)NCC21COCC2)C1CCN(CC1)C(=O)C1(CCCC1)C1C=CC=CC=1
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N1(CCC[C@H]1C(O)=O)C(=O)C1CCN(CC1)C(=O)[C@H](CC1C=CC=CC=1)NC(=O)OC(C)(C)C
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CC([C@@H](C(NCC(NC1C(C2C=CC=CC=2)C1)=O)=O)N)C
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OC(CN1CCN(C(CCC2=CC=CC=C2)=O)CC1)=O
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N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1C=CC(=CC=1)OC)C(=O)[C@H]1CCCO1
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CC1(C(=O)O)CN(CC(NCC2(C3C=CC=CC=3)CCCC2)=O)CC1
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C(C1C=CC=CC=1)C([H])(NC(=O)C([H])(N)C(C)C)C(=O)N.CC(=O)O
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CCCC(C(NCC(C1C=CC=CC=1)CCO)=O)N
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OC([C@H]1[C@@H](C2C=CC=CC=2)CN(C(CNC(COC2C=CC=CC=2)=O)=O)C1)=O
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C(=O)(CC(C)(C)C1C=CC=CC=1)N[C@@H]1CNC[C@H]1O
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| MCULE-1823215349 |
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CC1(C2=CC=CC=C2)CN(C(C2NCCC2)=O)CCC1
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N1(CC(=O)N[C@@H](CC(C)C)C(=O)N[C@H](C(=O)N[C@H](C)C(=O)N[C@@H](C(C)C)C1)CC1C=CC(=CC=1)OC)C(=O)[C@@H]1CCCO1
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CC(C(=O)O)N(C(CCCC1C=CC=CC=1)=O)CCNC(=O)C
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|
| MCULE-5414027036 |
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CC(C1=CC=CC=C1)CC(NC1C(=O)NCCCC1)=O
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C1(C2=CC=CC=C2Cl)(CC(=O)N2CCN(CC2)CCOC)CC(N(CCCOC)C1=O)=O
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CC(C(C(NC(C(=O)O)C)=O)NC(CC1C=CC2C=CC=CC=2C=1)=O)C
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| MCULE-2561942503 |
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CCCC(NC(C1NCCC1)=O)CC1=CC=CC=C1
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N1(CC(CC1C(N)=O)OC1=CC=CC=C1)C(CCC1C=CC(=CC=1)OC)=O
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| MCULE-8151460165 |
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OCC1CCN(CC(NCC(C2=CC3=C(C=CC=C3)C=C2)O)=O)CC1
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| MCULE-8950971269 |
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O=C(N1CCC(C2=C3C(C=CC=C3)=CC=C2)CC1)C1NC(=O)CC1
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N1(CCCC1C(O)=O)C(=O)C(CC1=CC=CC=C1)NC(OCC1C=CC=CC=1)=O
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|
| MCULE-6969370031 |
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N1(CC[C@H]([C@H](O)C1)C1=CC=C2C(C=CC=C2)=C1)C(=O)CN(C)CC
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O=C(N1C(C(N2CCNCC2)=O)CCC1)CC1C=CC=CC=1
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| MCULE-3967033315 |
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C(CC1=CC=CC=C1)(NC(CCC(O)=O)=O)C(O)=O
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|
| MCULE-6906198179 |
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COCCNCC(N1CC(C2=CC=CC=C2)CC1)=O
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|
| MCULE-1691049322 |
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CC(N1[C@@H](C(NCCC2NC3=C(C=CC=C3)C=2)=O)C[C@H](O)C1)=O
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| MCULE-8308482822 |
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N1(CC(=O)NC(C)C)CC(C)(C2=CC=CC=C2)CCC1=O
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|
| MCULE-1106729526 |
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O=C(NC1C(=O)NCCCC1)CCC1=CC=CC=C1
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|
| MCULE-3580728973 |
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C12(CCN(CC1)C(C1CCC1)=O)OC1=CC=C(C=C1)OCCNC([C@H](C)NC(=O)[C@H](CC1C=CC=CC=1)NC(=O)[C@H](C)NC2=O)=O
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| MCULE-1858984935 |
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O=C(NC1CC1)CN1CCN(C(C2N(C(CC3=CC=CC=C3)=O)CCC2)=O)CC1
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| MCULE-8732098884 |
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CC(NC(CN(C(C)=O)CCC1=CC=CC=C1)=O)CCC(O)=O
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| MCULE-1587260068 |
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N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1=CC=C(C=C1)OCC(=O)N[C@@H](C(C)C)C2=O)C(=O)N1CCC(CC1)(O)C1C=CC(=CC=1)Cl
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| MCULE-8393369134 |
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O=C(N1CC(CC2=CC=CC=C2)NCC1)CC1C(=O)NCC1
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| MCULE-4156827893 |
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O=C(N1C(C(NCCN2CCNCC2)=O)CCC1)CC1C=CC=CC=1
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| MCULE-7544359222 |
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N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)C1C=CSC=1)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
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| MCULE-9527506522 |
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CC1=C(CCNC(CN2CC(O)CCC2)=O)C=CC=C1
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|
| MCULE-8109812969 |
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CCCNC(CNC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O)=O
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| MCULE-9177682027 |
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| MCULE-1618722490 |
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CCC(C(=O)O)(CNC(CN(C(=O)C)CCC1C=CC=CC=1)=O)CC
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| MCULE-3624956562 |
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CC(C(C(NCC(=O)O)=O)NC(CC1C=CC=CC=1)=O)C
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| MCULE-3823567871 |
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N12CCC[C@H]1C(=O)NCCCC[C@H](NC(=O)CN1C=CN=C1C)C(N[C@@H](CC)C(=O)N[C@@H]([C@@H](C)O)C(=O)N[C@H](CC1=CC=CC=C1)C2=O)=O
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| MCULE-1793218004 |
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OC(C1CCN(CC(NCC2(C3C=CC=CC=3)CC2)=O)CC1)=O
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| MCULE-2271720957 |
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N1(CCCC2=CC=CC=C2)C(=O)CCC1(C)C(=O)NC1CCCC1
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| MCULE-5019314943 |
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[C@H](O)(C)[C@H](C(N[C@@H](CO)C(NCC(N1[C@H](CCC1)C(N[C@@H](CC(C)C)C(NCC(N[C@@H](CC(=O)N)C(N[C@@H](CC(C)C)C(N[C@H](C(N[C@@H](CCC(O)=O)C(N[C@H](CCC(O)=O)C(N[C@@H](CC(C)C)C(N[C@H](CC(=O)N)C(NCC(N[C@@H](C(N[C@@H](CO)C(N[C@H](CCCNC(N)=N)C(N[C@@H](CCCCN)C(N[C@@H](CCCCN)C(NCC(NCC(N[C@@H](C(N[C@@H](CO)C(N[C@@H](C(N[C@@H](CCCNC(N)=N)C(N[C@@H](C(N)=O)CC1C=CC=CC=1)=O)=O)CC1C=CC=CC=1)=O)=O)CC1C=CC=CC=1)=O)=O)=O)=O)=O)=O)=O)CC1C=CC(O)=CC=1)=O)=O)=O)=O)=O)=O)C)=O)=O)=O)=O)=O)=O)=O)=O)N
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| MCULE-3122734017 |
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CCN(C(CC1C=CC=CC=1)CNC(C1NCCCC1)=O)CC
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| MCULE-2098730181 |
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CC(C(NC(C)(C)C)=O)NC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O
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| MCULE-9093750648 |
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C1(=O)[C@@H]2CCCN2C(=O)CN(C/C=C(\C)/C)C[C@H]2OCC[C@@H]([C@@H]2O)NC(=O)[C@H](CC2=CC=CC=C2)NC(=O)[C@H](C)N1C
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CC(C(=O)O)N(C(CCC(C1C=CC=CC=1)(C)C)=O)CCNC(=O)C
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| MCULE-9991181130 |
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CC(NC(C1NC(=O)CC1)=O)CCC1=CC=CC=C1
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| MCULE-2904555625 |
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C(C1C=CC(O)=CC=1)[C@H](N)C(N[C@H](CCCCN)C(N[C@H](C(C)C)C(N[C@@H](CC(=O)N)C(N[C@@H](CCC(O)=O)C(N[C@H](C(N[C@H](CCC(N)=O)C(NCC(N1[C@@H](CCC1)C(N[C@H](C(C)C)C(N[C@@H](C(N1[C@@H](CCC1)C(N[C@H](CO)C(NCC(NCC(N[C@H](C(N[C@H](C(N[C@H](CC(C)C)C(N[C@@H](C(N[C@H](CCCNC(N)=N)C(N1[C@@H](CCC1)C(N[C@@H](CCCNC(N)=N)C(N[C@@H](CC(=O)N)C(N)=O)=O)=O)=O)=O)CC1C=CC=CC=1)=O)=O)CC1C=CC=CC=1)=O)CC1C=CC=CC=1)=O)=O)=O)=O)=O)C)=O)=O)=O)=O)=O)CC1C=CC(O)=CC=1)=O)=O)=O)=O)=O
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CN1C2(CC(C2)C1)CNC(CC(C1=CC=CC=C1)(O)C)=O
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| MCULE-6532779573 |
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CC1N(C(CN2CCN(C(C(CC3C=CC=CC=3)N)=O)CC2)=O)CCCC1
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| MCULE-6316610460 |
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CN(C(C(NCC(C1=CC(F)=CC=C1)O)=O)CC1=CC=CC=C1)C
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CC([C@@H](C(=O)O)NC(C(N1CCC(CC2C=CC=CC=2)CC1)C)=O)C
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CN(CC(N1CCN(C(C2N(C(CC3=CC=CC=C3)=O)CCC2)=O)CC1)=O)C
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CN1CC(CO)N(C(CCC2=CC=C(F)C=C2)=O)CC1
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| MCULE-1466976447 |
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O=C(C1NCCCC1)NCC(C1C=CC=CC=1)CC1C=CC=CC=1
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| MCULE-2119226676 |
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OCCN1CCN(CC(NCC2(C3=CC=CC=C3)CCC2)=O)CC1
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COCC1=CC(CC(N2[C@H](C(N)=O)C[C@H](OC)C2)=O)=CC=C1
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COCC(C(N1C(C)C(C2C=CC=CC=2)CC1)=O)N
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| MCULE-9663275725 |
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CN(C(CN1CCN(C(C(CC2C=CC=CC=2)N)=O)CC1)=O)C1CCCCC1
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CC(C(NCC(N1CC(CC2=CC(Cl)=CC=C2)(O)CC1)=O)=O)(C)C
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CC1=CC(CCC(N2CC(N3C(=O)CNCC3)CCC2)=O)=CC=C1
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CC(C(N(C)C)=O)NC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O
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FC(C1C=CC=C(C2(CC2)CNC(C2NCCC2)=O)C=1)(F)F
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| MCULE-1840312345 |
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N1(C[C@H]([C@H](N(C)C)C1)CO)C(CCC1=CC=CC=C1)=O
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| MCULE-5308118773 |
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CC(CN1CCN(CC(NCC2(C3=CC=CC=C3)CCC2)=O)CC1)O
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CN1C2(CCCCC2)C(=O)N(CC(N[C@H](C(O)=O)CC2=CC=CC=C2)=O)C1=O
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CC(C1C=CC=CC=1)CCC(N(C(C(=O)O)C)CCNC(=O)C)=O
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CC(C(C(N(CC(=O)O)C)=O)NC(CC1C=CC=CC=1)=O)C
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CN(C(CC1C=CC=C2C=1C=CC=C2)=O)CC(N1CC(C(=O)O)CCC1)=O
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FC1=CC=C(C2CN(C(C34N(C5CC5)CC(C3)C4)=O)CC2)C=C1
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| MCULE-5869982440 |
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CC1=CC=C(C2C(C)(C)N(C(CN3CC(=O)NCC3)=O)CC2)C=C1
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| MCULE-3077772149 |
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CCC(C1C=CC(C)=CC=1)CC(NC(C(=O)O)C(C)C)=O
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| MCULE-7050754411 |
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OC([C@@H]1N(CC(N2CCC(CC3C=CC=CC=3)CC2)=O)CCC1)=O
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| MCULE-2932107325 |
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CC(N(C(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O)CC(N)=O)C
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CC(C(C(NCCCCC(=O)O)=O)NC(CC1C=CC=CC=1)=O)C
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| MCULE-3633131562 |
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CC(C(=O)O)N(C(CCC1C=CC(Br)=CC=1)=O)CCNC(=O)C
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| MCULE-9897076704 |
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CCNC(CN(C(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O)CC)=O
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| MCULE-1108778446 |
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C(=O)(OC(C)(C)C)N1CCC(CC1)(C1C=CC=CC=1)C(=O)N[C@@H](C)C(=O)N[C@H](CC(C)C)C(O)=O
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CCC(NC(CNC(CCC1C=CC(C)=CC=1)=O)=O)(CC(=O)O)CC
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| MCULE-3835517027 |
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CCCN(C(C(C(C)C)NC(CC1=CC=CC=C1)=O)=O)CC(O)=O
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CC1CN(C(CNC(CC2C=CC=C3C=2C=CC=C3)=O)=O)CC(C(=O)O)C1
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N12C[C@H](C[C@H]1CN([C@@H](CC(C)C)C2=O)C(CCC1=CC=CC=C1)=O)NC(C)=O
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CCCC(C(=O)O)NC(CC(C1C=CC(C)=CC=1)CC)=O
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| MCULE-3740623705 |
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Cl.OC([C@@H]1N(CC(N2CCC(CC3=CC=CC=C3)CC2)=O)CCC1)=O
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|
| MCULE-9778998753 |
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CCC(C(O)=O)N1CCN(C(CCC2=CC=CC=C2)=O)CCC1.Cl
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NC(C(NC(CCC1CCNCC1)=O)CC1C=CC=CC=1)=O
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| MCULE-7938446738 |
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CO[C@@H]1CN(C(CC2=C3C(C=CC(=C3)OC)=CC=C2)=O)[C@H](C(N)=O)C1
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CCCC(C(NCCC(=O)O)=O)NC(CC1C=CC=CC=1)=O
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| MCULE-3231278906 |
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CC(C(C1C=CC=CC=1)C)NCC(N1CCC(C(=O)O)CC1)=O
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| MCULE-1091837758 |
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CC1(C(N2C[C@@H](C3C=CC=CC=3)[C@@H](C(=O)O)C2)=O)CCC1
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| MCULE-6081788160 |
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OCC1CCN(CC(N2C(CCC3=CC=CC=C3)C(O)CCC2)=O)CC1
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| MCULE-2080105180 |
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CC(C(C1=CC=CC=C1)CC(N1C(CO)(C)CC(O)C1)=O)C
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|
| MCULE-2624530157 |
0.67 |
O=C1N([C@H](C(N)=O)CC2C=CC=CC=2)CC[C@@H]2[C@@H](CCN(C(=O)C3CCCCC3)C2)C1
|
|
| MCULE-5250704934 |
0.67 |
CCCCC(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O
|
|
| MCULE-6767924603 |
0.67 |
NC(C(N1CCN(CC(NC2CCCCC2)=O)CC1)=O)CC1=CC=CC=C1
|
|
| MCULE-3135850037 |
0.67 |
C(=O)(CN1CCC(CC1)C(N)=O)N[C@@H](CC1=CC=CC=C1)C(N)=O
|
|
| MCULE-3423529502 |
0.67 |
N12CC(CC1CN(C(CC(C)C)C2=O)C(CCC1=CC=CC=C1)=O)NC(C)=O
|
|
| MCULE-2919494786 |
0.67 |
CCNC(CNC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O)=O
|
|
| MCULE-9280590424 |
0.67 |
OC([C@H]1N[C@@H](C(N2CCC3=C(C=CC=C3)CC2)=O)CC1)=O
|
|
| MCULE-6730846307 |
0.67 |
OC(C1=CC2=C(C=CC=C2)C=C1)CNC(CNC(C1CCCC1)=O)=O
|
|
| MCULE-5493308651 |
0.67 |
CC1NCCN(C(C2N(C(CC3C=CC=CC=3)=O)CCC2)=O)C1
|
|
| MCULE-4474950388 |
0.67 |
CC(N1[C@@H](C(N2[C@H](C3=CC=C(Cl)C=C3)[C@H](O)CC2)=O)C[C@H](O)C1)=O
|
|
| MCULE-1452934975 |
0.67 |
OC(C1N(C(CC(C2C=CC=CC=2)CC2C=CC=CC=2)=O)CCC1)=O
|
|
| MCULE-8403542181 |
0.67 |
CC(N(CC(NC(CCC(=O)O)(C)C)=O)CCC1C=CC=CC=1)=O
|
|
| MCULE-5877435277 |
0.67 |
CC(C(=O)O)N(CC(NCC1(C2C=CC=CC=2)CC1)=O)C
|
|
| MCULE-3669607308 |
0.67 |
N1(C(=O)CCC2=CC=C(C=C2C)C)C[C@H]2CCCN2C(=O)[C@@H]1C
|
|
| MCULE-7295601826 |
0.67 |
OC(C(NC(CC1CCCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-4453011802 |
0.67 |
C1(C2C=CC(=CC=2)C)(CC1)C(=O)N[C@H]1CNCC[C@H]1O
|
|
| MCULE-1601131579 |
0.67 |
CC(C(C1C=CC=CC=1)CC(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)C
|
|
| MCULE-3340895477 |
0.67 |
OC(C(NC(C12CC3CC(C1)CC(C3)C2)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-2478661352 |
0.67 |
CO[C@@H]1CN(C(CC2=C(F)C=C(F)C=C2)=O)[C@H](C(N)=O)C1
|
|
| MCULE-1141871248 |
0.67 |
CCCC(C(NCC(C(=O)O)C)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-7656754639 |
0.67 |
CC1C=CC=C(CCC(N2CC(CNC(C3NCCC3)=O)CCC2)=O)C=1
|
|
| MCULE-4656786548 |
0.67 |
N1C(=O)[C@@H](C)NCCCNC([C@H](CC2=CC=CC=C2)NC(=O)CN(C)C(=O)[C@@H]1C(C)C)=O
|
|
| MCULE-3922692450 |
0.67 |
CCC(CC(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)C
|
|
| MCULE-3540285105 |
0.67 |
CC(C(N1CC(CC2=CC=CC=C2)NCC1)=O)(C1CCC(O)CC1)C
|
|
| MCULE-8531934520 |
0.67 |
CC1C=CC(CCC(NCC(N2C(CCC(=O)O)CCCC2)=O)=O)=CC=1
|
|
| MCULE-4346345828 |
0.67 |
CCC(C(C(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)C)CC
|
|
| MCULE-4760337334 |
0.67 |
C(C1CCCCC1)(=O)N[C@H](CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-5356934360 |
0.67 |
C(=O)(N1CCOCC1)C1CC2(CN1C)CCN(CC2)C(CCC1=CC=CC=C1)=O
|
|
| MCULE-8615627734 |
0.67 |
N1(CC(O)=O)C[C@H]([C@H](C2C=CC(=CC=2)C)C1)NC(C)=O
|
|
| MCULE-6085151802 |
0.67 |
NC([C@@H](NC([C@H]1[C@H](C2=CC3=C(C=CC=C3)C=C2)C1)=O)CO)=O
|
|
| MCULE-1985285294 |
0.67 |
CC1=CC(CC(N2C(C(N3CCOCC3)=O)CCC2)=O)=CC=C1
|
|
| MCULE-3600483027 |
0.67 |
CC1=CC=C(CC2N(C(C3N(C(C4CC4)=O)CCC3)=O)CCC2)C=C1
|
|
| MCULE-8952079237 |
0.67 |
CCCC(N1CCC(C(NC(C(O)=O)CC2=CC=CC=C2)=O)CC1)=O
|
|
| MCULE-2639675240 |
0.67 |
C(=O)(N[C@H](C(C)C)C(=O)N[C@H](CC(C)C)C(O)=O)C1(C2C=CC=CC=2)CCN(CC1)C(=O)OC(C)(C)C
|
|
| MCULE-4450780534 |
0.67 |
CN1[C@@H](C(N[C@H]2[C@H](C3=CC=C(C(F)(F)F)C=C3)C2)=O)CCC1
|
|
| MCULE-9368303687 |
0.67 |
OC(C1N(C(CC(C2C=CC=CC=2)C2C=CC=CC=2)=O)CCC1)=O
|
|
| MCULE-4743509729 |
0.67 |
CC(C[C@@H](C(=O)O)NC(CNC(C(C1C=CC=CC=1)C1C=CC=CC=1)=O)=O)C
|
|
| MCULE-2766440473 |
0.67 |
CC(C1(C2=CC=CC=C2)CN(C([C@H]2N(C(N)=O)CCC2)=O)C1)C
|
|
| MCULE-3486377250 |
0.67 |
OC(C(NC(CCCC1CCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-6224415224 |
0.67 |
OC(CCCCNC(C(NC(C1C=CC=CC=1)=O)CC1C=CC=CC=1)=O)=O
|
|
| MCULE-3691765792 |
0.67 |
CC1=C(C2CN(C(C34N(C5CC5)CC(C3)C4)=O)CC2)C=CC=C1
|
|
| MCULE-3208218840 |
0.67 |
CC(CC(NCC(NCC(C(=O)O)CC1C=CC2C=CC=CC=2C=1)=O)=O)(C)C
|
|
| MCULE-2420339150 |
0.67 |
N1(CCC(CC1)C(=O)N[C@@H](CC1=CC=CC=C1)C(N)=O)C(C1CCC1)=O
|
|
| MCULE-3325566566 |
0.67 |
CC1(NCCN(C(C2C(C3=CC=CC=C3)CCCN2)=O)C1)C
|
|
| MCULE-7815267523 |
0.67 |
CCCC(C(NC(CCC(=O)O)C)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-7925766986 |
0.67 |
COCCCC(NC(C(=O)O)CC1C=CC=CC=1)=O
|
|
| MCULE-9814944439 |
0.67 |
CC(C(C(NC1C(CO)CCC1)=O)NC(CC1=CC=CC=C1)=O)C
|
|
| MCULE-3468446431 |
0.67 |
CC(C(N1CCC(C(NC(C(=O)O)CC2C=CC=CC=2)=O)CC1)=O)C
|
|
| MCULE-1935892081 |
0.67 |
CN(C(CCC1C=CC=CC=1C)=O)CC(N1CCC(C(=O)O)CC1)=O
|
|
| MCULE-6824753328 |
0.67 |
CC1N(C(C2NCCC2)=O)CC(C2=C(C)C=CC=C2)C1
|
|
| MCULE-8242216396 |
0.67 |
CCCC(C(N1CCC(C(=O)O)CC1)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-2075340523 |
0.67 |
OC(C1N(CC(NC(C2C=CC=CC=2)CC2C=CC=CC=2)=O)CCC1)=O.Cl
|
|
| MCULE-8172377791 |
0.67 |
FC(C1=CC=C(C2(CC2)CNC(C2N(C(C3CC3)=O)CCC2)=O)C=C1)(F)F
|
|
| MCULE-5309990327 |
0.67 |
C(C1CCCCC1)(=O)NC(CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-5656957536 |
0.67 |
N1C(=O)[C@@H](C)NC(=O)[C@H](CC2=CC=C(OC[C@H](CC3=CC=CC=C3)NC(=O)[C@@H](C(C)C)NC(=O)[C@@H]1[C@@H](C)O)C=C2)NC(C)=O
|
|
| MCULE-8259045602 |
0.67 |
FC(C1=CC=C([C@H]2[C@H](NC(C3N(C4CC4)CCC3)=O)C2)C=C1)(F)F
|
|
| MCULE-6377851377 |
0.67 |
CC(NCC(NCC(NCC(C(=O)O)CC1C=CC=CC=1)=O)=O)=O
|
|
| MCULE-8020372516 |
0.67 |
C1(C2=CC=CC=C2C)(CC(=O)N2CCNC(=O)C2)CC(N(CC)C1=O)=O
|
|
| MCULE-1099120730 |
0.67 |
CN(C(C1(C2C=CC=CC=2)CC1)=O)CC(N1CCC(C(=O)O)CC1)=O
|
|
| MCULE-2068182697 |
0.67 |
CC1(C(=O)O)N(C(CC(C2C=CC=CC=2)C2C=CC=CC=2)=O)CCC1
|
|
| MCULE-1248621251 |
0.67 |
CC(CC1C=CC(CC(N(CC(N2CCC(C(=O)O)CC2)=O)C)=O)=CC=1)C
|
|
| MCULE-8720111847 |
0.67 |
CC1N(C(C2NCCC2)=O)CC(C2=CC=C(F)C=C2)C1
|
|
| MCULE-5759631285 |
0.67 |
CC1(C(NC(C(=O)O)CC2C=CC=CC=2)=O)CCCCCC1
|
|
| MCULE-7192974722 |
0.67 |
O=C(NC(C(NC1CC1)=O)CC1C=CC=CC=1)CC1NCCOC1
|
|
| MCULE-1478712600 |
0.67 |
CC(C(NC(CNC(CCC1C=CC(C)=CC=1)=O)=O)(CC(=O)O)C)C
|
|
| MCULE-2116107605 |
0.67 |
O=C([C@H](NC(=O)[C@@H]1CC[C@@H](C(C)C)CC1)CC1C=CC=CC=1)O
|
|
| MCULE-1273130598 |
0.67 |
CCCC(N1CC(C(NC(C(=O)O)CC2C=CC=CC=2)=O)CCC1)=O
|
|
| MCULE-1098867532 |
0.67 |
N1(C[C@@H](C[C@H]1C(NC)=O)N)C(=O)C[C@@H](C)C1=CC=CC=C1
|
|
| MCULE-3509472878 |
0.67 |
CN1CC(C2=CC=CC=C2)C(NC(C2(CC2)O)=O)C1
|
|
| MCULE-9495648198 |
0.67 |
N1(CC[C@H]([C@H](O)C1)N1CCN(CC1)C)C(CCC1=CC=C(C=C1)F)=O
|
|
| MCULE-9012336668 |
0.67 |
CCCC(C(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)C
|
|
| MCULE-4508843817 |
0.67 |
OC(C(NC(C1C2(CC2)C1)=O)CC1=C2C(C=CC=C2)=CC=C1)=O
|
|
| MCULE-6500960582 |
0.67 |
C(=O)(OC(C)(C)C)N1CCC(CC1)(C1=CC=CC=C1)C(=O)N[C@@H](CC(C)C)C(=O)N[C@H](CC(C)C)C(O)=O
|
|
| MCULE-5756025035 |
0.67 |
C(=O)(C(C1C=CC=CC=1)C1=CC=CC=C1)N[C@@H](C(C)C)C(=O)N[C@H](CO)C(C)CC
|
|
| MCULE-8151349176 |
0.67 |
CC(CC(NCC(NCC(C(=O)O)CC1C=CC=C2C=1C=CC=C2)=O)=O)(C)C
|
|
| MCULE-6822851424 |
0.67 |
CC(CN1C(C(NC(CC(C2=CC=C(F)C=C2)O)C)=O)CCC1)C
|
|
| MCULE-8586897695 |
0.67 |
N1(C[C@H](C[C@H]1C(NC)=O)N)C(=O)C[C@@H](C)C1=CC=CC=C1
|
|
| MCULE-9143461913 |
0.67 |
OC([C@H](NC(CC1CCCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-1772169960 |
0.67 |
OCC(CC1=CC=C(F)C=C1)CNC(C1N2C(CCCC2)CC1)=O
|
|
| MCULE-1653668297 |
0.67 |
N12CC(CC1CN(C(CC(C)C)C2=O)C(CCC1=CC=CC=C1)=O)N(C)C
|
|
| MCULE-8227460986 |
0.67 |
CCCC(NCC(NCC(C(=O)O)CC1C=CC=C(C)C=1)=O)=O
|
|
| MCULE-3136182496 |
0.67 |
CC(C1C=CC=CC=1C)CC(N(CC(N1CCC(C(=O)O)CC1)=O)C)=O
|
|
| MCULE-4000792242 |
0.67 |
CCCC(C(N(CC(C(=O)O)C)C)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-3366538579 |
0.67 |
CC1=CC([C@H]2[C@H](C(N3CC(CO)(O)CC3)=O)C2)=CC=C1
|
|
| MCULE-3592813909 |
0.67 |
CC(C(C(C)=O)NC(CN1CC(C2=CC=CC=C2)CC1)=O)C
|
|
| MCULE-8146926906 |
0.67 |
O=C([C@@H]1NC(=O)CC1)NC1(CCCC1)CC1=CC=CC=C1
|
|
| MCULE-2953394630 |
0.67 |
N1(CCN(C)C)CC(=O)N[C@H](CC2C=CC(=CC=2)O)C1=O
|
|
| MCULE-8250627830 |
0.67 |
CC(C(C(NCC1(C2=C(C=CC=C2)CCC1)O)=O)N1C(=O)CCC1)C
|
|
| MCULE-9896916022 |
0.67 |
N1(C(=O)CCC2=CC=C(C=C2C)C)C[C@H]2CCCN2C(=O)[C@H]1C
|
|
| MCULE-4376190534 |
0.67 |
CC(N1C(=O)C(N2C[C@@H](C3C=CC=CC=3)[C@H](N)C2)CCC1)C
|
|
| MCULE-5336210762 |
0.67 |
O=C1C(CC2=CC=CC=C2)NCCN1
|
|
| MCULE-7488201404 |
0.67 |
CCC(C1C=CC=CC=1)CC(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O
|
|
| MCULE-6089953677 |
0.67 |
O=C([C@H]1CC[C@@H](C(C)C)CC1)N[C@@H](C(=O)O)CC1=CC=CC=C1
|
|
| MCULE-8529798852 |
0.67 |
C(=O)(N[C@@H](CC1C=CC(=CC=1)O)C(N)=O)C1(CCCCC1)N1CCCC1
|
|
| MCULE-8262140473 |
0.67 |
CCC(C1=CC=CC=C1)C1N(C(C2NC(=O)CC2)=O)CCC1
|
|
| MCULE-5146816664 |
0.67 |
CC(C(N1CCC(C(N[C@@H](C(=O)O)CC2C=CC=CC=2)=O)CC1)=O)C
|
|
| MCULE-9388493083 |
0.67 |
C1(=O)NCCN[C@H]1CC1=CC=CC=C1
|
|
| MCULE-4042498351 |
0.67 |
N1(CCCC(C2C=CC=CC=2)(C2C=CC=CC=2)C1)C(=O)[C@@H]1CCCN1C(C)=O
|
|
| MCULE-6840255051 |
0.67 |
N1(CC2CCC2)C[C@@H]([C@@H](C2C=CC=CC=2)C1)NC(=O)CCO
|
|
| MCULE-1000752059 |
0.67 |
CC1N(C(C2NCCCC2)=O)CC(C2C=CC=CC=2)C1
|
|
| MCULE-7224949757 |
0.67 |
OC([C@@H]1N(CC(N2CCC(CC3=CC=CC=C3)CC2)=O)CCC1)=O
|
|
| MCULE-9514990170 |
0.67 |
CCCC(NCC(NCC(C(=O)O)CC1C=CC=C2C=1C=CC=C2)=O)=O
|
|
| MCULE-2472025877 |
0.67 |
FC1=CC=C(C2(CC2)CNC(C2NC(=O)CC2)=O)C=C1
|
|
| MCULE-3014133387 |
0.67 |
CCCC(C(N(CCC(=O)O)CC)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-2710907097 |
0.67 |
CN(C(C1CCCCCC1)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-4592604582 |
0.67 |
CC(C(N1CC(C(NC(C(=O)O)CC2C=CC=CC=2)=O)CCC1)=O)(C)C
|
|
| MCULE-2284850814 |
0.67 |
CC1(C2=CC=CC=C2)CCN(C(C(NC(N)=O)CO)=O)CC1
|
|
| MCULE-5131504087 |
0.67 |
C(C(=O)N)(CC1C=CC(O)=CC=1)NC(=O)C(N)C(C)CC
|
|
| MCULE-6270943463 |
0.67 |
CC1C=CC(CCC(NCC(N(CCC2C=CC=CC=2)CCN)=O)=O)=CC=1
|
|
| MCULE-3558697769 |
0.67 |
N1(CCCC(C2C=CC=C(C)C=2)C1)C(=O)CN1CCCC1=O
|
|
| MCULE-3718650766 |
0.67 |
COCC1(CCNCC1)CNC(C(CC1C=CC=CC=1)N)=O
|
|
| MCULE-3983810207 |
0.67 |
C(=O)([C@@H]1CCC(=O)N1)N1CCC(CC1)(CO)CCC1C=CC=CC=1
|
|
| MCULE-4272669331 |
0.67 |
CCN(C(C1C(C2=CC=CC=C2)CCCN1)=O)CC(NC)=O
|
|
| MCULE-5691616975 |
0.67 |
CC1C=CC(CCC(NCC(N[C@@H]2C[C@H](C(=O)O)C2)=O)=O)=CC=1
|
|
| MCULE-3748765814 |
0.67 |
CCCN(CC(NCC1(C2=CC=CC=C2)CC1)=O)CC(O)=O
|
|
| MCULE-9948375907 |
0.67 |
COCC(N(CC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O)C)=O
|
|
| MCULE-9876316823 |
0.67 |
CC(N1C(C(NCCC(C2=CC=CC=C2)O)=O)CCCC1)C
|
|
| MCULE-3467078485 |
0.67 |
N1(CC(O)CN(CCC2C=CC=CC=2)C(=O)C1)C(C1CCOCC1)=O
|
|
| MCULE-3756888760 |
0.67 |
CC(CCC(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)(C)C
|
|
| MCULE-6773276788 |
0.67 |
OC(C1CN(CC(NCCCC2C=CC=CC=2)=O)CCC1)=O
|
|
| MCULE-4125495743 |
0.67 |
CC(C(N(C(C(=O)O)C)CCNC(=O)C)=O)CC1C=CC=C(F)C=1
|
|
| MCULE-1020190634 |
0.67 |
CC(NC([C@H]1N(C(N)=O)CCC1)=O)CC1=CC2=C(C=CC=C2)C=C1
|
|
| MCULE-3779712152 |
0.67 |
CC(C(N1CCC(C(N(C(C(=O)O)CC2C=CC=CC=2)C)=O)CC1)=O)C
|
|
| MCULE-5379491242 |
0.67 |
N12CCC[C@@H]1C(=O)N[C@@H](C)C(=O)N[C@@H](CC1C=CC(=CC=1)OCC(=O)N[C@H](CC1=CC=CC=C1)C2=O)C(=O)N1CCC(CC1)N(C)C
|
|
| MCULE-8324802297 |
0.67 |
OC(C1N(CC(N2CCC(CC3C=CC=CC=3)CC2)=O)CCC1)=O
|
|
| MCULE-4169032494 |
0.67 |
OC([C@H](NC(CCC1CCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-2659095452 |
0.67 |
CN(C(C1CN(C(C(C)(C)C)=O)CCC1)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-4048353216 |
0.67 |
N12C[C@H](C[C@H]1CN([C@@H](CC(C)C)C2=O)C(CCC1=CC=CC=C1)=O)N(C)C
|
|
| MCULE-9203309519 |
0.67 |
CC(N(CC(N1CC2C(O)C(CCC2)C1)=O)CCC1=CC=CC=C1)=O
|
|
| MCULE-3503292296 |
0.67 |
CC(C(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)C1CC1
|
|
| MCULE-6297525686 |
0.67 |
C(=O)(C(N)CC1=CC=C(O)C=C1)NCC(=O)NCC(O)=O
|
|
| MCULE-2954953794 |
0.67 |
CC1C=CC=C(CC(C(=O)O)CNC(CNC(CC(C)(C)C)=O)=O)C=1
|
|
| MCULE-4279088717 |
0.67 |
CN1C2(CCCCC2)C(=O)N(CC(N[C@@H](C(O)=O)CC2=CC=CC=C2)=O)C1=O
|
|
| MCULE-7176289749 |
0.67 |
[H][C@@](C(NCC(NCC(=O)O)=O)=O)(CC1C=CC(O)=CC=1)N
|
|
| MCULE-1115296352 |
0.67 |
CN(C(C1NCCC1)=O)CC1CCN(CC(C2=CC=CC=C2)O)CC1.Cl
|
|
| MCULE-6205891516 |
0.67 |
C(=O)(N[C@@H](C(C)C)C(=O)N[C@H](CC(C)C)C(O)=O)C1(C2C=CC=CC=2)CCN(CC1)C(=O)OC(C)(C)C
|
|
| MCULE-6178593767 |
0.67 |
CC(C[C@@H](C(=O)O)NC(CNC(CCCC1C=CC(C)=CC=1)=O)=O)C
|
|
| MCULE-2787423230 |
0.67 |
N1(CCCC1)C1(CCCC1)CNC(=O)[C@@H](O)CC1C=CC=CC=1
|
|
| MCULE-3432680406 |
0.67 |
CC(C(C(N1CC(C(=O)O)CCC1)=O)NC(CC1C=CC2C=CC=CC=2C=1)=O)C
|
|
| MCULE-7379685652 |
0.67 |
CCC(C(C(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)C)C
|
|
| MCULE-9112292060 |
0.67 |
CC1CN(CC(NCCCC2C=CC=CC=2)=O)CC(C(=O)O)C1
|
|
| MCULE-1901122791 |
0.67 |
CC1(CN(C([C@H](N2C(=O)C3C=CC=CC=3C2)CC2=CC=CC=C2)=O)CCC1)O
|
|
| MCULE-7841035255 |
0.67 |
CC(C(=O)O)N(CC(N1CCC(NC(CCC2C=CC=CC=2)=O)CC1)=O)C
|
|
| MCULE-4237033567 |
0.67 |
CC1(CC(C(N[C@@H](C(=O)O)CC2C=CC=CC=2)=O)CCC1)C
|
|
| MCULE-2441373720 |
0.67 |
C(=O)(OC(C)(C)C)N1CCC(CC1)(C1=CC=CC=C1)C(=O)NC(CC(C)C)C(=O)NC(CC(C)C)C(O)=O
|
|
| MCULE-2384399250 |
0.67 |
OC([C@H]1N(CC(N2CCC(CC3C=CC=CC=3)CC2)=O)CCC1)=O
|
|
| MCULE-3908069595 |
0.67 |
C(=O)(C1CCC(CC1)CCCC)NC(CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-1817143672 |
0.67 |
C1(C=CC=CC=1)C[C@@H](C(=O)O)NC(=O)CC[C@H](N)C(=O)O
|
|
| MCULE-6592343486 |
0.67 |
N1(C(=O)CCC2=CC=C(C=C2C)C)C[C@@H]2CCCN2C(=O)[C@H]1C
|
|
| MCULE-3968879415 |
0.67 |
CN(C(CCC1CCCC1)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-4507370702 |
0.67 |
COCCCC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O
|
|
| MCULE-6260488649 |
0.67 |
CCCC(C(N(CCC(=O)O)C)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-9544135396 |
0.67 |
CN(C(CC1CCCC1)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-5364093371 |
0.67 |
CC1(C(C)(C)C1C(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)C
|
|
| MCULE-3828684246 |
0.67 |
OC(C1=CC=CC=C1)CNC(CNC(CC1CCCCC1)=O)=O
|
|
| MCULE-1041310896 |
0.67 |
CC(C(NC(C(=O)O)CC1C=CC=CC=1)=O)(C1CCCC1)C
|
|
| MCULE-6354974462 |
0.67 |
N1(C)[C@@H](C)C(=O)N[C@@H](CC2=CC=CC=C2)C(=O)N[C@H]2CCO[C@@H]([C@H]2O)CN(C(CCC2C=CC(=CC=2)Cl)=O)CC(=O)N[C@H](CC(C)C)C1=O
|
|
| MCULE-5896690591 |
0.67 |
N1(CCC(CC1)C(=O)N[C@@H](CC1C=CC=CC=1)C(O)=O)C(C1CCC1)=O
|
|
| MCULE-4082873085 |
0.67 |
C1(N(CCNC1=O)CCCC1C=CC=CC=1)CC(O)=O
|
|
| MCULE-2223053648 |
0.67 |
CC(OC(N1[C@@H](C(N2CCN(C(C(C3=CC=CC=C3)(C)C)=O)CC2)=O)C[C@H](O)C1)=O)(C)C
|
|
| MCULE-9429942703 |
0.67 |
CC(CCC(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)C
|
|
| MCULE-5496956336 |
0.67 |
CCC1(C(NC(C(=O)O)CC2C=CC=CC=2)=O)CCCC1
|
|
| MCULE-3163892234 |
0.67 |
OC([C@@H]1CN(C(CNC(CC2C=CC=C3C=2C=CC=C3)=O)=O)CCC1)=O
|
|
| MCULE-3542375251 |
0.67 |
C(=O)(C(C1C=CC=CC=1)C1=CC=CC=C1)NC(C(C)C)C(=O)NC(CO)C(C)CC
|
|
| MCULE-4995576562 |
0.67 |
CC[C@@H]1CC[C@@H](C(N[C@@H](C(=O)O)CC2C=CC=CC=2)=O)CC1
|
|
| MCULE-3187155360 |
0.67 |
C1(CC2C(=CC=CC=2)C1)(N1CCN(CC1)CC)C(=O)N1CCC(CC1)COC
|
|
| MCULE-4737591346 |
0.67 |
CC(CC(C(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)(C)C)C
|
|
| MCULE-4748076858 |
0.67 |
C(=O)([C@@H]1CC[C@H](CC1)C(C)C)N[C@]([H])(CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-3685140775 |
0.67 |
CCCC(C(N1C[C@@H](C2C=CC=CC=2)[C@@H](C(=O)O)C1)=O)C(C)C
|
|
| MCULE-1934920202 |
0.67 |
CC1=CC(C2(CCCC2)CNC(C2NCCC2)=O)=CC=C1
|
|
| MCULE-9760903667 |
0.67 |
OC([C@H](NC(C1CCCCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-3113962400 |
0.67 |
C1(C2=CC=C(C=C2)C)(CC1)C(=O)N1C[C@@H]([C@@H](N2CCN(CC2)C)C1)O
|
|
| MCULE-8199629877 |
0.67 |
C1(C=CC(O)=CC=1)C[C@H](N)C(=O)NCC(=O)NCC(=O)O
|
|
| MCULE-1121042617 |
0.67 |
OC(C(NC(C1CCCCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-1760384411 |
0.67 |
N12C[C@H](C[C@H]1CN([C@@H](CC1C=CC=CC=1)C2=O)CC1C=COC=1)OC
|
|
| MCULE-4732425740 |
0.67 |
CCCC(C(NCC(C(=O)O)(C)C)=O)NC(CC1C=CC=CC=1)=O
|
|
| MCULE-3793893073 |
0.67 |
CC(C(=O)O)N1CCN(C(CCC2C=CC=CC=2)=O)CCC1
|
|
| MCULE-5495380565 |
0.67 |
OC(C1CN(CC(NCC2(C3C=CC=CC=3)CCCC2)=O)CC1)=O
|
|
| MCULE-1081621294 |
0.67 |
CC1CN(C(CNC(CC2C=CC=CC=2)=O)=O)CC(C(=O)O)C1
|
|
| MCULE-1732491092 |
0.67 |
CC(N1CCC(C(N[C@@H](C(=O)O)CC2C=CC=CC=2)=O)CC1)=O
|
|
| MCULE-6360485818 |
0.67 |
N1(CC(O)CN(CCC2C=CC=CC=2)C(=O)C1)C(=O)CC(C)C
|
|
| MCULE-3757333131 |
0.67 |
NC(C(NC(C1CC(C(=O)O)CCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-4140882692 |
0.67 |
CC(C(NC(C(=O)O)CC1C=CC=CC=1)=O)CC1CCCC1
|
|
| MCULE-7311545333 |
0.67 |
N1(C[C@H]([C@H](C(O)=O)C1)C1C=CC=CC=1C)C(=O)C(C)(C)N1CCOCC1
|
|
| MCULE-9937054688 |
0.67 |
OC([C@@H]1CN(C(CNC(CC2C=CC=CC=2)=O)=O)CCC1)=O
|
|
| MCULE-1714187217 |
0.67 |
N1(CCN(C)C)CC(=O)N[C@@H](CC2=CC=C(C=C2)O)C1=O
|
|
| MCULE-6431159093 |
0.67 |
CC(C1OCCC1)NC(C1N(C(CC2=CC=CC=C2)=O)CCC1)=O
|
|
| MCULE-4615555034 |
0.67 |
CC(N(CC(N1CC2(COCC2)CC1)=O)CCC1=CC=CC=C1)=O
|
|
| MCULE-8618972269 |
0.67 |
OC([C@H](NC(CC1CCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-9808948303 |
0.67 |
CC(C(=O)O)N(C(CCCC1C=CC2C=CC=CC=2C=1)=O)CCNC(=O)C
|
|
| MCULE-1165319947 |
0.67 |
CC(C(C(N1CC(C(=O)O)CC(C)C1)=O)NC(CC1C=CC=CC=1)=O)C
|
|
| MCULE-9795310382 |
0.67 |
CN(C(CCC1CCC1)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-8399874419 |
0.67 |
O=C(C1(C2=CC=CC=C2)NCCC1)NC1COCC1
|
|
| MCULE-6505595352 |
0.67 |
CC1C(CCNC(CN2[C@H](C(=O)O)CCC2)=O)=C(C)C=C(C(C)(C)C)C=1
|
|
| MCULE-1488001515 |
0.67 |
CCC1(C(NC(C(=O)O)CC2C=CC=CC=2)=O)CCCCC1
|
|
| MCULE-2528045390 |
0.67 |
COC1C(C)(C)C(NC(C(CC2C=CC=CC=2)N)=O)C1
|
|
| MCULE-4890466490 |
0.67 |
CC1C(CCNC(CN2C(C(=O)O)CCC2)=O)=C(C)C=C(C(C)(C)C)C=1
|
|
| MCULE-8928752932 |
0.67 |
C(=O)(C1CCC(CC1)C)NC(CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-4732200780 |
0.67 |
C(=O)(C(C)(C)C1C=CC=CC=1)N[C@@H]1CCN(C[C@H]1O)CC(=O)N(C)C
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|
| MCULE-7936463238 |
0.67 |
CC1(C(=O)O)CN(C(CNC(CC2C=CC=CC=2)=O)=O)CCC1
|
|
| MCULE-2197559388 |
0.67 |
OC(C1CN(CC(NCC2(C3=CC=CC=C3)CC2)=O)CC1)=O
|
|
| MCULE-2606570560 |
0.67 |
[C@@H]1(C(O)=O)CN(C[C@H]1C1=CC=CC(F)=C1)C(=O)CN1CCOCC1
|
|
| MCULE-4140798980 |
0.67 |
N1(CCC2(CC1)CCCO2)C(=O)CN1CCC(C2=CC=CC=C2)C1
|
|
| MCULE-4342842667 |
0.67 |
OC(C(NC(CCC1CCC1)=O)CC1=CC=CC=C1)=O
|
|
| MCULE-5871547821 |
0.67 |
COCCCC(N(C(C(=O)O)CC1C=CC=CC=1)C)=O
|
|
| MCULE-7986810559 |
0.67 |
C1(CC2C(=CC=CC=2)C1)(N1CCN(CC1)CC)C(=O)N1CCN2C(CCC2)C1
|
|
| MCULE-1181566066 |
0.67 |
CN(C(C1CCCCC1)=O)C(C(=O)O)CC1C=CC=CC=1
|
|
| MCULE-8854161389 |
0.67 |
C(=O)(OC(C)(C)C)N1CCC(CC1)(C1C=CC=CC=1)C(=O)NC(C)C(=O)NC(CC(C)C)C(O)=O
|
|
| MCULE-9924736858 |
0.67 |
C1C(N2CC3(CN(C(=O)CC4=CC=CC=C4)C[C@@H]4C[C@H](CN34)O)C2)CCN(C(C)=O)C1
|
|
| MCULE-3854479317 |
0.67 |
OC(C(NC(CC1CCCC1)=O)CC1C=CC=CC=1)=O
|
|
| MCULE-9733903141 |
0.67 |
N1[C@@H](C(C)C)C(=O)N(C)CC(=O)N[C@@H](CC2C=CC=CC=2)C(NCCCN(C(C)=O)[C@H](C)C1=O)=O
|
|
| MCULE-1476476727 |
0.67 |
N1(C[C@@H](C)O[C@@H](C)C1)C(=O)CN1C[C@H](CC2C=CC=CC=2)NC(=O)C1
|
|
| MCULE-2465488449 |
0.67 |
CC(N1CCC(C(NC(C(=O)O)CC2C=CC=CC=2)=O)CC1)=O
|
|
| MCULE-7954537496 |
0.67 |
C1(=O)N(CCCC1(CNCCNC)O)CCC1=CC=CC=C1
|
|
| MCULE-8597115465 |
0.67 |
OC(C1(NC(CNC(CC2C=CC=CC=2)=O)=O)CCCCCC1)=O
|
|
| MCULE-9534850292 |
0.67 |
C12(CC3CC(CC(C3)C1)C2)CC(=O)NC(CC1C=CC=CC=1)C(O)=O
|
|
| MCULE-8602192176 |
0.67 |
CC([C@@H](C(NCC(N1C(C)CC(C2C=CC(F)=CC=2)C1)=O)=O)N)C
|
|
| MCULE-5807801468 |
0.67 |
C1(N(C)CCC2=CC=CC=C2)(CC2C(=CC=CC=2)C1)C(=O)NC(CO)CO
|
|
| MCULE-4875327391 |
0.67 |
CC1(CCCCC1)CC(N[C@@H](C(=O)O)CC1C=CC=CC=1)=O
|
|
| MCULE-7985528482 |
0.67 |
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