| MCULE-3015385363 |
0.67 |
C12C(CC(CC=1CC1(CC2(O)CC(C1)(C)C)C)(C)C)NC(=O)C1C=CC(=CC=1)N(=O)=O
|
|
| MolPort-002-511-434 |
0.67 |
CC1=CC[C@]23O[C@@]2(C)CC[C@H]2C(CN4CCN(CC4)C(=O)C4=CC=CC=C4)C(=O)O[C@@H]2[C@@H]13
|
|
| MolPort-002-513-363 |
0.64 |
C[C@H](NCC1[C@@H]2[C@@H](CC3=CCCC(C)[C@@]3(C)C2O)OC1=O)C1=CC=CC=C1
|
|
| MolPort-003-812-894 |
0.64 |
CC1(C)CC(NC(=O)C2=CC=C(C=C2)[N+]([O-])=O)C2=C(C1)CC1(C)CC(C)(C)CC2(O)C1
|
|
| MCULE-1710010577 |
0.63 |
O[C@H]1[C@H](O)[C@H](O)C=C(C(NC2C3C(OCC3)CCC2)=O)C1
|
|
| MCULE-8772954371 |
0.63 |
O[C@H]1[C@H](O)[C@H](O)C=C(C(N2CC3C(COC3)CC2)=O)C1
|
|
| MolPort-002-528-084 |
0.63 |
C[C@@]12OC1C[C@@H]1[C@H]2[C@H]2OC(=O)C(CN3CCN(CC3)C(=O)C3=CC=CC=C3)[C@@H]2CCC1=C
|
|
| MolPort-002-513-554 |
0.63 |
CC1=C2C[C@H]3[C@@H](C[C@@]2(C)CCC1)OC(=O)C3CNCC1=CC=C(F)C=C1
|
|
| MolPort-002-521-231 |
0.63 |
CC1CCC=C2C[C@H]3OC(=O)C(CNC4CCN(CC5=CC=CC=C5)CC4)[C@H]3C(O)[C@]12C
|
|
| MolPort-044-872-207 |
0.63 |
O[C@@H]1CC(=C[C@@H](O)[C@H]1O)C(=O)NC1CCCC2OCCC12
|
|
| MolPort-044-872-476 |
0.63 |
O[C@@H]1CC(=C[C@@H](O)[C@H]1O)C(=O)N1CCC2COCC2C1
|
|
| MolPort-044-872-266 |
0.62 |
CC1(CNC(=O)C2=C[C@@H](O)[C@@H](O)[C@H](O)C2)CCOC1C1CC1
|
|
| MolPort-044-872-136 |
0.62 |
CC1(C)C(NC(=O)C2=C[C@@H](O)[C@@H](O)[C@H](O)C2)C2CCOC12
|
|
| MCULE-6754444475 |
0.62 |
CC1(C(C2CC2)OCC1)CNC(C1C[C@@H](O)[C@H](O)[C@H](O)C=1)=O
|
|
| MCULE-5678233901 |
0.62 |
CC1(C2C(CCO2)C1NC(C1C[C@@H](O)[C@H](O)[C@H](O)C=1)=O)C
|
|
| MCULE-5928542463 |
0.62 |
CCC1=CC=C(C(N2CC=C(C3(C(O)=O)CCOCC3)CC2)=O)C=C1
|
|
| MCULE-1355350219 |
0.62 |
C1(C(=O)NCC2=CC=CC=C2)=C(C)C(OC21CCCCCC2)=O
|
|
| MCULE-5796167398 |
0.62 |
O[C@H]1[C@H](O)[C@H](O)C=C(C(NC2CC3(CCCC3)OCC2)=O)C1
|
|
| MCULE-1583539518 |
0.62 |
C1C2C(C(=O)NCC3C=CC=CC=3)C(C(=O)O)C(O2)C=1
|
|
| MCULE-3590813761 |
0.62 |
OCC1(N(CC2=CC=CC=C2)CCOC1)CNC(C1C[C@@H](O)[C@H](O)[C@H](O)C=1)=O
|
|
| MolPort-035-669-069 |
0.62 |
CC(NC(C[C@@H]1C(=C)CCC2[C@](C)(COC(C)=O)[C@@H](CC[C@@]12C)OC(C)=O)C1=CCOC1=O)C1=CC=CC=C1
|
|
| MolPort-046-537-604 |
0.62 |
CCC1=CC=C(C=C1)C(=O)N1CCC(=CC1)C1(CCOCC1)C(O)=O
|
|
| MolPort-044-860-006 |
0.62 |
O[C@@H]1CC(=C[C@@H](O)[C@H]1O)C(=O)NC1CCOC2(CCCC2)C1
|
|
| MolPort-002-514-591 |
0.62 |
C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)C(CNCC4=CC=CC=C4)[C@H]3C=C12
|
|
| MolPort-002-523-891 |
0.62 |
C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)C(CN(C)CC4=CC=CC=C4)[C@H]3C=C12
|
|
| MolPort-002-519-855 |
0.62 |
CC1CCC=C2C[C@H]3OC(=O)C(CN4CCN(CC5=CC=CC=C5)CC4)[C@H]3C(O)[C@]12C
|
|
| MolPort-046-503-834 |
0.62 |
OCC1(CNC(=O)C2=C[C@@H](O)[C@@H](O)[C@H](O)C2)COCCN1CC1=CC=CC=C1
|
|
| MolPort-023-236-207 |
0.61 |
O=C(OCC1CN(CC2=CC=CC=C2)C(=O)C1)C1CCC=CC1
|
|
| MolPort-002-528-402 |
0.61 |
C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)C(CN(CC4=CC=CC=C4)CC4=CC=CC=C4)[C@H]3C=C12
|
|
| MolPort-044-859-975 |
0.61 |
CCOC1CC(NC(=O)C2=C[C@@H](O)[C@@H](O)[C@H](O)C2)C11CCCC1
|
|
| MolPort-002-532-106 |
0.61 |
CC1=C2C[C@H]3[C@@H](C[C@@]2(C)CCC1)OC(=O)C3CN1CCN(CC2=CC=CC=C2)CC1
|
|
| MolPort-023-240-268 |
0.61 |
O=C(OCC1CCCN(C1)C(=O)C1=CC=CC=C1)C1CC=CC1
|
|
| MCULE-7662497070 |
0.61 |
O=C(C1CC=CCC1)OCC1CC(=O)N(CC2=CC=CC=C2)C1
|
|
| MCULE-1350865932 |
0.61 |
CCOC1C2(CCCC2)C(NC(C2C[C@@H](O)[C@H](O)[C@H](O)C=2)=O)C1
|
|
| MCULE-6644351026 |
0.61 |
O=C(C1CC=CC1)OCC1CN(C(C2=CC=CC=C2)=O)CCC1
|
|
| MCULE-6742087192 |
0.61 |
CC1(C2C(CCCO2)C1NC(C1C[C@@H](O)[C@H](O)[C@H](O)C=1)=O)C
|
|
| MCULE-6856100731 |
0.61 |
O[C@H]1[C@H](O)[C@H](O)C=C(C(NC2CC3(CCCCC3)OCC2)=O)C1
|
|
| MCULE-7182439480 |
0.61 |
C1(=C(C)C(OC21CCCCCC2)=O)C(=O)NC(C)C1C=CC=CC=1
|
|
| MCULE-6112972442 |
0.61 |
[C@H]1(NC(C2=CC=CC=C2)=O)[C@@H]2CCO[C@@H]2[C@@H]1COC
|
|
| MolPort-044-872-219 |
0.61 |
O[C@@H]1CC(=C[C@@H](O)[C@H]1O)C(=O)NC1CCOC2(CCCCC2)C1
|
|
| MolPort-044-872-157 |
0.61 |
CC1(C)C(NC(=O)C2=C[C@@H](O)[C@@H](O)[C@H](O)C2)C2CCCOC12
|
|
| MolPort-007-753-924 |
0.61 |
CC(NC(=O)C1=C(C)C(=O)OC11CCCCCC1)C1=CC=CC=C1
|
|
| MolPort-038-392-110 |
0.61 |
COC[C@@H]1[C@@H](NC(=O)C2=CC=CC=C2)[C@@H]2CCO[C@H]12
|
|
| MolPort-002-519-403 |
0.61 |
C[C@H](NCC1[C@H]2C=C3[C@@H](C)CCC[C@]3(C)C[C@H]2OC1=O)C1=CC=CC=C1
|
|
| MolPort-044-860-063 |
0.60 |
O[C@@H]1CC(=C[C@@H](O)[C@H]1O)C(=O)NC1CCOC(C1)C1CC1
|
|
| MolPort-045-929-132 |
0.60 |
O=C(C1CC(=O)OC11CCCC1)N(CCC1=CCCCC1)CC1=CC=CC=C1
|
|
| MolPort-007-753-931 |
0.60 |
CC1=C(C(=O)NCC2=C(C)C=CC=C2)C2(CCCCCC2)OC1=O
|
|
| MolPort-046-473-225 |
0.60 |
O=C(NCC1=CCCOC1)C1=CC=CC(=C1)C(=O)N1CCCCC1
|
|
| MolPort-038-408-279 |
0.60 |
COC[C@@H]1[C@H](NC(=O)C2=CC=CC3=CC=CC=C23)[C@@H]2CCO[C@H]12
|
|
| MolPort-002-517-870 |
0.60 |
C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)C(CN(CCO)CC4=CC=CC=C4)[C@H]3C=C12
|
|
| MolPort-002-530-736 |
0.60 |
CN(CC1[C@H]2C=C3C(C)=CCC[C@]3(C)C[C@H]2OC1=O)CC1=CC=CC=C1
|
|
| MolPort-044-872-220 |
0.60 |
O[C@@H]1CC(=C[C@@H](O)[C@H]1O)C(=O)NC1CCOC2(CCC2)C1
|
|
| MolPort-007-927-309 |
0.60 |
CC1=C(C(=O)NCC2=CC=C(C)C=C2)C2(CCCCC2)OC1=O
|
|
| MolPort-008-293-021 |
0.60 |
CC(NC(=O)C1C2OC(C=C2)C1C(O)=O)C1=CC=C(C=C1)C(C)(C)C
|
|
| MolPort-046-639-701 |
0.60 |
CC1=CC=C(C(=O)N2CCC(=CC2)C2(CCOCC2)C(O)=O)C(O)=C1
|
|
| MolPort-044-859-958 |
0.60 |
CCOC1CC(NC(=O)C2=C[C@@H](O)[C@@H](O)[C@H](O)C2)C11CCCCC1
|
|
| MolPort-044-859-972 |
0.60 |
CC1CN(C1C1=CC=CC=C1)C(=O)C1=C[C@@H](O)[C@@H](O)[C@H](O)C1
|
|
| MolPort-044-859-977 |
0.60 |
O[C@@H]1CC(=C[C@@H](O)[C@H]1O)C(=O)N1CCCCCC1C1=CC=CC=C1
|
|
| MolPort-046-639-702 |
0.60 |
OC(=O)C1(CCOCC1)C1=CCN(CC1)C(=O)C1=CC=C(Cl)C=C1
|
|
| MCULE-9843705644 |
0.60 |
O[C@H]1[C@H](O)[C@H](O)C=C(C(NC2CC(C3CC3)OCC2)=O)C1
|
|
| MCULE-9325952542 |
0.60 |
C1(CC(OC21CCCC2)=O)C(=O)N(CCC1CCCCC=1)CC1=CC=CC=C1
|
|
| MCULE-1253046864 |
0.60 |
C1(C(=O)NCC2=CC=CC=C2C)=C(C)C(OC21CCCCCC2)=O
|
|
| MCULE-4896089301 |
0.60 |
[C@H]1([C@@H]2CCO[C@@H]2[C@@H]1COC)NC(=O)C1=CC=CC2C=CC=CC1=2
|
|
| MCULE-2422384920 |
0.60 |
O=C(C1=CC(C(N2CCCCC2)=O)=CC=C1)NCC1COCCC=1
|
|
| MCULE-5589903752 |
0.60 |
C1(C2C=CC(O2)C1C(O)=O)C(=O)NC(C)C1=CC=C(C=C1)C(C)(C)C
|
|
| MCULE-6386975849 |
0.60 |
C1(C(=O)NCC2C=CC(=CC=2)C)=C(C)C(OC21CCCCC2)=O
|
|
| MCULE-2397044335 |
0.60 |
O[C@H]1[C@H](O)[C@H](O)C=C(C(NC2CC3(CCC3)OCC2)=O)C1
|
|
| MCULE-2234909966 |
0.60 |
CC1=CC(O)=C(C(N2CC=C(C3(C(O)=O)CCOCC3)CC2)=O)C=C1
|
|
| MCULE-8137149586 |
0.60 |
CCOC1C2(CCCCC2)C(NC(C2C[C@@H](O)[C@H](O)[C@H](O)C=2)=O)C1
|
|
| MCULE-5144110847 |
0.60 |
OC(C1(C2CCN(C(C3=CC=C(Cl)C=C3)=O)CC=2)CCOCC1)=O
|
|
| MCULE-5300440194 |
0.60 |
CC1C(C2=CC=CC=C2)N(C(C2C[C@@H](O)[C@H](O)[C@H](O)C=2)=O)C1
|
|
| MCULE-4077422168 |
0.60 |
O[C@H]1[C@H](O)[C@H](O)C=C(C(N2C(C3=CC=CC=C3)CCCCC2)=O)C1
|
|
| MCULE-6690491060 |
0.60 |
C1(C(NCCCN(CCCC)CC2C=CC=CC=2)=O)=C(C)C(OC21CCCCCC2)=O
|
|
| MCULE-7491975112 |
0.60 |
C1(C(NCCCN(C(C)C)CC2C=CC=CC=2)=O)=C(C)C(OC21CCCCCC2)=O
|
|
| MCULE-8862651701 |
0.60 |
CN(C(C1=CC=CC=C1)=O)C1CC2N(CC3COCCC=3)C(CC2)C1
|
|
| MCULE-1830414690 |
0.60 |
[C@H]1([C@@H]2CCO[C@@H]2[C@@H]1COC)NC(=O)C1=CC=C2C(C=CC=C2)=C1O
|
|
| MCULE-5169438907 |
0.60 |
C1(C2C=CC(O2)C1C(O)=O)C(=O)NC(C1C=CC=CC=1)C1=CC=CC=C1
|
|
