| MolPort-039-339-192 |
1 |
O=c1cccc2[C@@H]3C[C@@H](Cn12)[C@@H]1CCCCN1C3 |
|
| MolPort-002-526-184 |
1 |
O=c1cccc2[C@@H]3C[C@@H](Cn12)[C@H]1CCCCN1C3 |
|
| MolPort-039-339-192 |
1 |
O=c1cccc2[C@@H]3C[C@@H](Cn12)[C@@H]1CCCCN1C3 |
|
| MCULE-1158432248 |
1 |
C12OC(C(O)(C)C)CC=1C(O)=C1C(=O)C(C3C=CC(O)=CC=3)=COC1=C2 |
|
| MolPort-035-705-633 |
0.99 |
O=c1cccc2[C@H]3CCCN4CCC[C@H](Cn12)[C@@H]34 |
|
| MolPort-002-529-724 |
0.99 |
O=c1cccc2[C@H]3CCCN4CCC[C@@H](Cn12)[C@@H]34 |
|
| MolPort-035-705-633 |
0.99 |
O=c1cccc2[C@H]3CCCN4CCC[C@H](Cn12)[C@@H]34 |
|
| MolPort-039-194-137 |
0.99 |
[I-].C[N+]12CCC[C@@H]1[C@H]1C[C@H](C2)c2cccc(=O)n2C1 |
|
| MolPort-039-194-137 |
0.99 |
[I-].C[N+]12CCC[C@@H]1[C@H]1C[C@H](C2)c2cccc(=O)n2C1 |
|
| MolPort-003-182-336 |
0.97 |
CC(C)(C)C1CCC(CC1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-508-431 |
0.97 |
CN1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-506-861 |
0.97 |
O=c1cccc2[C@@H]3CNC[C@@H](C3)Cn12 |
|
| MolPort-003-848-812 |
0.97 |
CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-016-586-265 |
0.97 |
O=c1cccc2C3CC(CN(C3)C3C4CC5CC(C4)CC3C5)Cn12 |
|
| MolPort-003-182-329 |
0.97 |
O=c1cccc2C3CC(CN(CC4CCCCC4)C3)Cn12 |
|
| MolPort-044-722-497 |
0.97 |
CC(C)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-003-182-331 |
0.97 |
CC1CCC(CC1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-016-586-272 |
0.97 |
O=c1cccc2C3CC(CN(C3)C3CC4CCC3C4)Cn12 |
|
| MolPort-046-589-967 |
0.97 |
CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-052-289 |
0.97 |
CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-000-163-367 |
0.97 |
O=c1cccc2C3CNCC(C3)Cn12 |
|
| MolPort-046-763-667 |
0.97 |
CN1C[C@H]2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-160-234 |
0.97 |
CN1CCC(CC1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-019-596-537 |
0.97 |
CCN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-000-880-972 |
0.97 |
O=c1cccc2[C@H]3CNC[C@H](C3)Cn12 |
|
| MolPort-046-765-528 |
0.97 |
[2H]C1([2H])NC([2H])([2H])[C@@H]2C[C@H]1Cn1c2cccc1=O |
|
| MolPort-044-722-502 |
0.97 |
CCCN1CCC(CC1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-000-147-478 |
0.97 |
O=c1cccc2[C@@H]3CNC[C@H](C3)Cn12 |
|
| MolPort-046-763-667 |
0.97 |
CN1C[C@H]2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-052-289 |
0.97 |
CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-722-502 |
0.97 |
CCCN1CCC(CC1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-044-722-497 |
0.97 |
CC(C)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-046-589-967 |
0.97 |
CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-765-528 |
0.97 |
[2H]C1([2H])NC([2H])([2H])[C@@H]2C[C@H]1Cn1c2cccc1=O |
|
| MolPort-046-479-071 |
0.96 |
O=c1cccc2[C@@H]3C[C@@H](CN(CC4C5CCCCC45)C3)Cn12 |
|
| MolPort-045-968-461 |
0.96 |
O=c1cccc2C3CC(CN(C3)C3CCC(CC3)c3ccccc3)Cn12 |
|
| MolPort-045-968-461 |
0.96 |
O=c1cccc2C3CC(CN(C3)C3CCC(CC3)c3ccccc3)Cn12 |
|
| MolPort-046-479-071 |
0.96 |
O=c1cccc2[C@@H]3C[C@@H](CN(CC4C5CCCCC45)C3)Cn12 |
|
| MolPort-001-746-579 |
0.96 |
NC[C@H]1C[C@@H]2CC[N@]1C[C@@H]2CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-129-064 |
0.95 |
Cl.O=c1cccc2C3CC(CN(C3)C3CCCC3)Cn12 |
|
| MolPort-042-610-973 |
0.95 |
Cl.FC(F)(F)CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-129-064 |
0.95 |
Cl.O=c1cccc2C3CC(CN(C3)C3CCCC3)Cn12 |
|
| MolPort-042-610-973 |
0.95 |
Cl.FC(F)(F)CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-044-810-021 |
0.94 |
Cl.Cl.NCCN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-810-021 |
0.94 |
Cl.Cl.NCCN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-035-765-978 |
0.93 |
O=c1cccc2[C@@H]3C[C@@H](CN(CCN4C[C@@H]5C[C@H](C4)c4cccc(=O)n4C5)C3)Cn12 |
|
| MolPort-044-181-381 |
0.93 |
O=c1cccc2C3C[C@@H](CN(CCN4C[C@@H]5CC(C4)c4cccc(=O)n4C5)C3)Cn12 |
|
| MolPort-044-181-381 |
0.93 |
O=c1cccc2C3C[C@@H](CN(CCN4C[C@@H]5CC(C4)c4cccc(=O)n4C5)C3)Cn12 |
|
| MolPort-035-765-978 |
0.93 |
O=c1cccc2[C@@H]3C[C@@H](CN(CCN4C[C@@H]5C[C@H](C4)c4cccc(=O)n4C5)C3)Cn12 |
|
| MCULE-6930369995 |
0.93 |
C12O[C@H](C(O)(C)C)[C@@H](O)C=1C(O)=C1C(=O)C(C3C=CC(O)=CC=3)=COC1=C2 |
|
| MolPort-002-512-162 |
0.92 |
O=c1cccc2C3C[C@H](CN(CCC#N)C3)Cn12 |
|
| MolPort-002-512-668 |
0.92 |
O=C(CCCC(=O)CCN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)CCN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-018-611-313 |
0.92 |
O=c1cccc2[C@H]3C[C@H](CN(CC#N)C3)Cn12 |
|
| MolPort-002-515-018 |
0.92 |
O=c1cccc2[C@@H]3C[C@@H](CN(CCC#N)C3)Cn12 |
|
| MolPort-009-757-772 |
0.92 |
[I-].CC(O)C[N+]1(C)C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-512-894 |
0.92 |
CCN(CC)CC(O)CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-790-400 |
0.92 |
C=CCCN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-004-975-613 |
0.92 |
CC(=O)CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-000-723-791 |
0.92 |
[I-].C[N+]1(CCO)C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-004-948-917 |
0.92 |
CC(O)CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-509-387 |
0.92 |
OCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-423-722 |
0.92 |
O=c1cccc2[C@H]3C[C@H](CN(CCCC#N)C3)Cn12 |
|
| MolPort-044-566-047 |
0.92 |
O=c1cccc2C3CC(CN(CCC#N)C3)Cn12 |
|
| MolPort-002-514-764 |
0.92 |
NC(=O)CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-596-391 |
0.92 |
O=c1cccc2[C@H]3C[C@@H](CN(CCCC#N)C3)Cn12 |
|
| MolPort-016-586-255 |
0.92 |
CC(CCN1CC2CC(C1)c1cccc(=O)n1C2)c1ccccc1 |
|
| MolPort-002-511-888 |
0.92 |
O=c1cccc2[C@@H]3C[C@@H](CN(CCCC#N)C3)Cn12 |
|
| MolPort-045-968-460 |
0.92 |
O=c1cccc2C3CC(CN(CCCc4ccccc4)C3)Cn12 |
|
| MolPort-004-946-727 |
0.92 |
OCCN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-045-968-460 |
0.92 |
O=c1cccc2C3CC(CN(CCCc4ccccc4)C3)Cn12 |
|
| MolPort-046-423-722 |
0.92 |
O=c1cccc2[C@H]3C[C@H](CN(CCCC#N)C3)Cn12 |
|
| MolPort-046-596-391 |
0.92 |
O=c1cccc2[C@H]3C[C@@H](CN(CCCC#N)C3)Cn12 |
|
| MolPort-044-566-047 |
0.92 |
O=c1cccc2C3CC(CN(CCC#N)C3)Cn12 |
|
| MolPort-046-790-400 |
0.92 |
C=CCCN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-016-586-284 |
0.91 |
O=c1cccc2C3CC(CN(C3)C3Cc4ccccc4C3)Cn12 |
|
| MolPort-044-722-491 |
0.91 |
CC(=O)N1CCC(CC1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-044-722-493 |
0.91 |
O=c1cccc2C3CC(CN(CC(c4ccccc4)c4ccccc4)C3)Cn12 |
|
| MolPort-000-700-341 |
0.91 |
[Cl-].NCC(O)C[NH+]1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-009-757-827 |
0.91 |
Cl.NCC(O)CN1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-722-491 |
0.91 |
CC(=O)N1CCC(CC1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-044-722-493 |
0.91 |
O=c1cccc2C3CC(CN(CC(c4ccccc4)c4ccccc4)C3)Cn12 |
|
| MolPort-002-508-595 |
0.90 |
CC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-626-451 |
0.90 |
CC(=O)N1CC2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-513-277 |
0.90 |
NC(=O)CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-626-451 |
0.90 |
CC(=O)N1CC2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-003-182-892 |
0.90 |
CC(CCC=C(C)C)CCN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-045-903-027 |
0.89 |
CC(CCC=C(C)C)CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-008-375-811 |
0.89 |
O[C@@]1(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)CCCN2CCCC[C@H]12 |
|
| MolPort-002-026-030 |
0.89 |
O=c1cccc2C3CC(CN(Cc4ccccc4)C3)Cn12 |
|
| MolPort-045-903-027 |
0.89 |
CC(CCC=C(C)C)CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-160-217 |
0.88 |
O=c1cccc2C3CC(CN(Cc4ccc5ccccc5c4)C3)Cn12 |
|
| MolPort-006-315-626 |
0.88 |
NCCCCCC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-005-911-260 |
0.88 |
O=C(CCCC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)NC[C@@H]1CCCN2CCCC[C@H]12 |
|
| MolPort-002-508-824 |
0.88 |
O=C(CCC(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)NCC1CCCCC1 |
|
| MolPort-039-193-923 |
0.88 |
CCCC(CC(C)=O)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-423-757 |
0.88 |
CCCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-514-991 |
0.88 |
O=c1cccc2[C@@H]3C[C@@H](CN(CN4C[C@H]5C[C@@H](C4)c4cccc(=O)n4C5)C3)Cn12 |
|
| MolPort-003-182-340 |
0.88 |
O=c1cccc2C3CC(CN(Cc4cccc5ccccc45)C3)Cn12 |
|
| MolPort-005-975-439 |
0.88 |
O=C(CCC(=O)N1CC2CC(C1)c1cccc(=O)n1C2)NCC1CCCN2CCCCC12 |
|
| MolPort-039-193-922 |
0.88 |
CCCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-512-222 |
0.88 |
OC(=O)CCN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-509-506 |
0.88 |
CCCC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-301-303 |
0.88 |
FC(F)(F)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-006-315-627 |
0.88 |
NCCC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-008-347-072 |
0.88 |
O=C(CCC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)NC[C@@H]1CCCN2CCCC[C@H]12 |
|
| MolPort-002-160-231 |
0.88 |
O=c1cccc2C3CC(CN(Cc4ccc5ccc6cccc7ccc4c5c67)C3)Cn12 |
|
| MolPort-004-969-383 |
0.88 |
OC(=O)CCN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-046-423-757 |
0.88 |
CCCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-923 |
0.88 |
CCCC(CC(C)=O)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-922 |
0.88 |
CCCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-921 |
0.87 |
CCCCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-915 |
0.87 |
O=C(CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)NC1CCCCC1 |
|
| MolPort-002-160-235 |
0.87 |
Cc1ccccc1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-512-674 |
0.87 |
ON1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-000-832-559 |
0.87 |
Cl.NCCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-423-688 |
0.87 |
ON1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-516-708 |
0.87 |
O=C(CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccccc1 |
|
| MolPort-030-042-329 |
0.87 |
NCC(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-517-914 |
0.87 |
OC(CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccccc1 |
|
| MolPort-035-669-011 |
0.87 |
CC(O)(CC[C@H]1[C@](C)(O)CCC2C(C)(C)CCC[C@]12C)C(O)CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-906 |
0.87 |
CCCCCC(CCC(C)=O)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-509-242 |
0.87 |
O=C(CCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)NC1CCCCC1 |
|
| MolPort-002-509-489 |
0.87 |
CCCCC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-000-818-430 |
0.87 |
Cl.NCCCCCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-508-678 |
0.87 |
CC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-509-773 |
0.87 |
CC(C)NC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-179-293 |
0.87 |
O=C(CCCCCn1cccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-129-063 |
0.87 |
O=C(CC1CC1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-006-315-628 |
0.87 |
C[C@H](N)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-000-822-364 |
0.87 |
Cl.NCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-507-324 |
0.87 |
NCCCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-006-315-641 |
0.87 |
NCCCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-554-133 |
0.87 |
Cl.NCCC(=O)N1CC2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-075-545 |
0.87 |
Cl.CNC(=O)CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-103 |
0.87 |
OC(CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccccc1 |
|
| MolPort-016-586-243 |
0.87 |
CCc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MCULE-9774749633 |
0.87 |
C12OC(C)(C)CCC=1C(O)=C1C(=O)C(C3C=CC(O)=CC=3)=COC1=C2 |
|
| MolPort-030-042-329 |
0.87 |
NCC(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MCULE-2320957502 |
0.87 |
C12O[C@H](C(O)(C)C)[C@@H](OC)C=1C(O)=C1C(=O)C(C3C=CC(O)=CC=3)=COC1=C2 |
|
| MolPort-039-075-545 |
0.87 |
Cl.CNC(=O)CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-921 |
0.87 |
CCCCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
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OC(CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccccc1 |
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| MolPort-028-926-937 |
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OC(=O)CN1CC2CC(C1)c1cccc(=O)n1C2 |
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Cl.NCCC(=O)N1CC2C[C@H](C1)c1cccc(=O)n1C2 |
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Cl.NCCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
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ON1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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| MolPort-039-193-906 |
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CCCCCC(CCC(C)=O)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
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O=C(CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)NC1CCCCC1 |
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CC(O)(CC[C@H]1[C@](C)(O)CCC2C(C)(C)CCC[C@]12C)C(O)CN1CC2CC(C1)c1cccc(=O)n1C2 |
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O=C(CC1CC1)N1CC2CC(C1)c1cccc(=O)n1C2 |
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Cl.OC(=O)CN1CC2CC(C1)c1cccc(=O)n1C2 |
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OC(=O)CN1CC2CC(C1)c1cccc(=O)n1C2 |
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Cc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
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Cl.NCCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
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Cl.OC(=O)CN1CC2CC(C1)c1cccc(=O)n1C2 |
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Cl.C[C@H](N)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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Cc1cccc(CN2CC3CC(C2)c2cccc(=O)n2C3)c1 |
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OC(CCl)CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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FC(F)(F)c1ccccc1CN1CC2CC(C1)c1cccc(=O)n1C2 |
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CC(C)C(N)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
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CC(NC(=O)C(C)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C1CC2CCC1C2 |
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OC(CCl)CN1CC2CC(C1)c1cccc(=O)n1C2 |
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[Cl-].CC([NH3+])C(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
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Cl.NCCCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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O=C(C1CCNCC1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
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OC(CCl)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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CC(C)N1CCC(CC1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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Cl.O=C(CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2ccccc2c1 |
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CC(C)C(N)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
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[Cl-].CCC(C)[C@H]([NH3+])C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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C=CC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
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[Cl-].CC(C)CC([NH3+])C(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
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Cl.CCC(C)[C@H](N)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
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Cl.CNCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
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COC(=O)CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
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C1(O)C=C2OC=C(C3C=CC(O)=CC=3)C(=O)C2=C2OC(C)(C)CCC=12 |
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CC[C@H](C)[C@H](N)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
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CC(C)C[C@H](N)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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OC(CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)Cc1ccccc1 |
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COCC(O)CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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CNCC(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
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CC(C)(C)[C@H]1CC[C@@](CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(CC1)n1cccc1 |
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COC(=O)CCN1CC2CC(C1)c1cccc(=O)n1C2 |
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COC(=O)CCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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Cl.CNCC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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C=CC(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
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CNCC(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
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CC(C)C[C@H](N)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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O=C(C#C)N1CC2CC(C1)c1cccc(=O)n1C2 |
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Cl.O=C(C1CCNCC1)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2 |
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CC(C)(C)C1CCC(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(CC1)n1cccc1 |
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Cc1ccc(nc1)C1(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)CCNCC1 |
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O=C(CC1(CCCCC1)n1cccc1)N1CC2CC(C1)c1cccc(=O)n1C2 |
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O=C(CC1(CCCCC1)n1cccc1)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2 |
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CC(C)(C)C1CCC(CC(=O)N2C[C@@H]3CC(C2)c2cccc(=O)n2C3)(CC1)n1cccc1 |
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C=CC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
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Cl.CC(C)C[C@@H](N)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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COC(=O)CCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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Cl.CNCC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
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OC(C[NH+]1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)Cn1ccc2ccccc12 |
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Cl.OC(CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)Cn1ccc2ccccc12 |
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C=CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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Cl.CC(C)C[C@@H](N)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
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CC(C)(C)[C@H]1CC[C@@](CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(CC1)n1cccc1 |
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Cl.O=C(C1CCNCC1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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CC[C@H](C)[C@H](N)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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Cl.O=C(C1CCNCC1)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2 |
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OCC#CCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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NC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
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CC(C)C[C@H](N)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
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CC(C)(C)C1CCC(CC(=O)N2C[C@@H]3CC(C2)c2cccc(=O)n2C3)(CC1)n1cccc1 |
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Cl.CC(C)C[C@H](N)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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CCC(C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccccc1 |
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CC(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C12CC3CC(CC(C3)C1)C2 |
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CC(NC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)C12CC3CC(CC(C3)C1)C2 |
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CC1=C(CCN2CC3CC(C2)c2cccc(=O)n2C3)C(C)(C)CCC1 |
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Cc1ccc(C)n1CCCCCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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O=C(CCc1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
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ClC(Cl)(Cl)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
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O=C(Cc1ccc2ccccc2c1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
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O=C(CCCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)NCCc1ccccc1 |
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O=c1cccc2C3CC(CN(C3)C(=S)NC3CCCCC3)Cn12 |
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Cc1ccc(C)c(CN2CC3CC(C2)c2cccc(=O)n2C3)c1 |
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CNC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
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Oc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
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ClC(Cl)(Cl)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
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CCC(C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccccc1 |
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ClC(Cl)(Cl)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
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Fc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
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NC(=N)N1CC2CC(C1)c1cccc(=O)n1C2 |
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CN(C)c1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
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CC(=C)C(=O)N1C[C@H]2CC(C1)c1cccc(=O)n1C2 |
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| MolPort-002-509-652 |
0.84 |
CCC(C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccccc1 |
|
| MolPort-016-586-249 |
0.84 |
CCN(CC)c1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-056-039 |
0.84 |
Cc1ccc(C)n1CCCCCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-042-645-904 |
0.84 |
O=C(CC1(Cn2cccc2)CCCCC1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-722-489 |
0.84 |
CC1=C(CCN2CC3CC(C2)c2cccc(=O)n2C3)C(C)(C)CCC1 |
|
| MolPort-039-194-277 |
0.84 |
CC(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C12CC3CC(CC(C3)C1)C2 |
|
| MolPort-015-163-729 |
0.84 |
O=Cc1ccc(cc1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-023-307-573 |
0.84 |
CC(NC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)C12CC3CC(CC(C3)C1)C2 |
|
| MolPort-002-515-617 |
0.84 |
CCCCCCCCCCCCNC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-741-201 |
0.84 |
O=c1cccc2[C@H]3C[C@@H](CN(C3)C(=S)NC3CC4CCC3C4)Cn12 |
|
| MolPort-009-757-866 |
0.83 |
Cl.CN(C)c1ccc(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-046-626-453 |
0.83 |
O=NN1CC2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-020-179-893 |
0.83 |
COC(=O)CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-075-551 |
0.83 |
Cl.O=c1cccc2C3CC(CN(C3)C3CCOCC3)Cn12 |
|
| MolPort-002-160-265 |
0.83 |
Fc1cccc(CN2CC3CC(C2)c2cccc(=O)n2C3)c1 |
|
| MolPort-005-910-363 |
0.83 |
CC(C)NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-035-873-235 |
0.83 |
O=C(CCn1ccc2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-431-952 |
0.83 |
O=C(CCn1ccc2ccccc12)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-003-055-925 |
0.83 |
CCNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-513-052 |
0.83 |
COC(=O)CN1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-016-586-525 |
0.83 |
O=c1cccc2C3CC(CN(Cc4ccnc5ccccc45)C3)Cn12 |
|
| MolPort-003-055-926 |
0.83 |
CCCCNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-916 |
0.83 |
CCNC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-008-383-430 |
0.83 |
Brc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-193-901 |
0.83 |
CNC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-023-276-844 |
0.83 |
Brc1ccc2[C@H]3CNC[C@H](C3)Cn2c1=O |
|
| MolPort-003-182-339 |
0.83 |
Oc1cccc(CN2CC3CC(C2)c2cccc(=O)n2C3)c1 |
|
| MolPort-002-534-330 |
0.83 |
CN(C)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-513-800 |
0.83 |
O=NN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-035-669-002 |
0.83 |
O=NN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-016-586-263 |
0.83 |
Brc1ccccc1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-018-611-312 |
0.83 |
O=NN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-000-727-072 |
0.83 |
[Cl-].CN(C)c1ccc(C[NH+]2C[C@@H]3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-005-947-064 |
0.83 |
CC(C)(C)CC(=O)N1CC[C@@H](CC(O)=O)[C@@H](CCN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)C1 |
|
| MolPort-006-668-820 |
0.83 |
CC(C)(C)C(=O)N1CC[C@@H](CC(O)=O)[C@@H](CCN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)C1 |
|
| MolPort-002-514-384 |
0.83 |
O=C(NC1CCCCC1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-598-013 |
0.83 |
O=C(NC1CCCCC1)N1CC2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-005-909-841 |
0.83 |
O=c1cccc2[C@@H]3C[C@@H](CN(C3)C(=S)NC3CC3)Cn12 |
|
| MolPort-016-586-259 |
0.83 |
Clc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-057-386 |
0.83 |
Cc1ccc(C)n1CCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-005-973-398 |
0.83 |
O=c1cccc2C3CC(CN(C3)C(=S)NC3CC3)Cn12 |
|
| MolPort-005-974-539 |
0.83 |
CC(C)NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-045-903-021 |
0.83 |
O=c1cccc2C3CC(CN(Cc4cccnc4)C3)Cn12 |
|
| MolPort-001-905-869 |
0.83 |
Oc1ccccc1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-026-031 |
0.83 |
Fc1ccccc1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-035-873-229 |
0.83 |
C[C@H](C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc(C[C@@H]2CCCC2=O)cc1 |
|
| MolPort-038-432-196 |
0.83 |
CC(C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc(CC2CCCC2=O)cc1 |
|
| MolPort-045-903-021 |
0.83 |
O=c1cccc2C3CC(CN(Cc4cccnc4)C3)Cn12 |
|
| MolPort-023-276-844 |
0.83 |
Brc1ccc2[C@H]3CNC[C@H](C3)Cn2c1=O |
|
| MolPort-035-873-229 |
0.83 |
C[C@H](C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc(C[C@@H]2CCCC2=O)cc1 |
|
| MolPort-038-432-196 |
0.83 |
CC(C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc(CC2CCCC2=O)cc1 |
|
| MolPort-044-431-952 |
0.83 |
O=C(CCn1ccc2ccccc12)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-057-386 |
0.83 |
Cc1ccc(C)n1CCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-035-873-235 |
0.83 |
O=C(CCn1ccc2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-598-013 |
0.83 |
O=C(NC1CCCCC1)N1CC2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-626-453 |
0.83 |
O=NN1CC2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-075-551 |
0.83 |
Cl.O=c1cccc2C3CC(CN(C3)C3CCOCC3)Cn12 |
|
| MolPort-039-193-916 |
0.83 |
CCNC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-020-179-893 |
0.83 |
COC(=O)CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-035-669-002 |
0.83 |
O=NN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-901 |
0.83 |
CNC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-514-180 |
0.82 |
CCC(NC(C)=O)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-956 |
0.82 |
CC(C)OCC(O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-057-551 |
0.82 |
Cc1ccc(C)n1CCCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-006-315-625 |
0.82 |
N[C@@H](Cc1ccccc1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-598-074 |
0.82 |
OC(CNc1ccc(O)cc1)C[NH+]1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-000-752-945 |
0.82 |
[Cl-].CC(C)(C)OCC(O)C[NH+]1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-513-789 |
0.82 |
CC(C)CC(NC(C)=O)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-000-733-644 |
0.82 |
[Cl-].[NH3+][C@@H](Cc1ccccc1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-514-344 |
0.82 |
CC(C)C(NC(C)=O)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-016-586-248 |
0.82 |
Oc1ccc2ccccc2c1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-018 |
0.82 |
CCC(NC(C)=O)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-016-586-287 |
0.82 |
Cl.O=c1cccc2C3CC(CN(Cc4ccc(cc4)-c4ccccc4)C3)Cn12 |
|
| MolPort-046-598-068 |
0.82 |
CC(C)(C)OCC(O)C[NH+]1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-057-902 |
0.82 |
C[C@H](C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cccc1 |
|
| MolPort-002-026-035 |
0.82 |
Clc1ccc(cc1)C(=O)CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-510-380 |
0.82 |
CC(CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)Cc1cc(C)cc(C)c1 |
|
| MolPort-039-129-065 |
0.82 |
O=c1cccc2C3CC(CN(C3)c3ncccn3)Cn12 |
|
| MolPort-039-193-898 |
0.82 |
CCCCSCC(O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-045-903-047 |
0.82 |
Brc1cccc(CN2CC3CC(C2)c2cccc(=O)n2C3)c1 |
|
| MolPort-000-824-702 |
0.82 |
Cl.N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-016-586-244 |
0.82 |
Fc1cccc(F)c1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-513-883 |
0.82 |
CCS(=O)(=O)CCN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-003-055-927 |
0.82 |
O=c1cccc2C3CC(CN(C3)C(=S)NCCc3ccccc3)Cn12 |
|
| MolPort-039-194-029 |
0.82 |
CC(C)C(NC(C)=O)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-020-179-894 |
0.82 |
Brc1ccc(cc1)C(=O)CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-046-785-155 |
0.82 |
CC#CC(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-511-097 |
0.82 |
O=C(CCC(=O)c1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-509-572 |
0.82 |
O=C(C(c1ccccc1)c1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-943 |
0.82 |
O=C(CCC(=O)c1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-135 |
0.82 |
CCC(C)[C@H](NC(C)=O)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-009-758-191 |
0.82 |
Cl.CC(C)(C)OCC(O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-016-586-276 |
0.82 |
Clc1ccccc1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-009-745-061 |
0.82 |
O=C(CC(c1ccccc1)c1ccccc1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-527-168 |
0.82 |
CCC(C)C(NC(C)=O)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-008-160-355 |
0.82 |
OC(=O)CCC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-996 |
0.82 |
CC(C)CC(NC(C)=O)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-056-994 |
0.82 |
CC(C)[C@H](C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cccc1 |
|
| MolPort-002-516-269 |
0.82 |
ClC(Cl)(Cl)C(NC=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-512-255 |
0.82 |
CCOC(=O)CN1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-056-696 |
0.82 |
O=C(C1CN(CCc2ccccc2)C(=O)C1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-160-226 |
0.82 |
Clc1c2ccccc2c(CN2CC3CC(C2)c2cccc(=O)n2C3)c2ccccc12 |
|
| MolPort-046-540-824 |
0.82 |
COC(=O)[C@@H]1CC[C@H](CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)C1 |
|
| MolPort-039-194-029 |
0.82 |
CC(C)C(NC(C)=O)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-598-074 |
0.82 |
OC(CNc1ccc(O)cc1)C[NH+]1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-057-551 |
0.82 |
Cc1ccc(C)n1CCCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-018 |
0.82 |
CCC(NC(C)=O)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-956 |
0.82 |
CC(C)OCC(O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-020-179-894 |
0.82 |
Brc1ccc(cc1)C(=O)CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-955 |
0.82 |
CCOCC(O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-045-903-047 |
0.82 |
Brc1cccc(CN2CC3CC(C2)c2cccc(=O)n2C3)c1 |
|
| MolPort-039-129-065 |
0.82 |
O=c1cccc2C3CC(CN(C3)c3ncccn3)Cn12 |
|
| MolPort-039-193-996 |
0.82 |
CC(C)CC(NC(C)=O)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-598-068 |
0.82 |
CC(C)(C)OCC(O)C[NH+]1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-057-902 |
0.82 |
C[C@H](C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cccc1 |
|
| MolPort-046-785-155 |
0.82 |
CC#CC(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-046-540-824 |
0.82 |
COC(=O)[C@@H]1CC[C@H](CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)C1 |
|
| MolPort-039-056-696 |
0.82 |
O=C(C1CN(CCc2ccccc2)C(=O)C1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-902 |
0.82 |
CCCCCCCCSCC(O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-423-893 |
0.82 |
CCCCCCCCSCC(O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-943 |
0.82 |
O=C(CCC(=O)c1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-898 |
0.82 |
CCCCSCC(O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-003-757-703 |
0.82 |
OC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-135 |
0.82 |
CCC(C)[C@H](NC(C)=O)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-000-848-353 |
0.82 |
OC(=O)CCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-423-893 |
0.82 |
CCCCCCCCSCC(O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-902 |
0.82 |
CCCCCCCCSCC(O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-955 |
0.82 |
CCOCC(O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-056-994 |
0.82 |
CC(C)[C@H](C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cccc1 |
|
| MCULE-1107338486 |
0.81 |
C12OC(C(O)(C)C)CC=1C(O)=C1C(=O)C(C3C=C(O)C(O)=CC=3)=COC1=C2C/C=C(\C)/C |
|
| MolPort-039-194-001 |
0.81 |
Cl.CCS(=O)(=O)CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-006-316-350 |
0.81 |
OC(=O)CCCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-016-591-515 |
0.81 |
OC(=O)CCCC(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-005-025-902 |
0.81 |
Fc1ccc(CC2(CCC(=O)N3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)CCC(=O)N2)cc1 |
|
| MolPort-039-129-062 |
0.81 |
COCC(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-015-137-384 |
0.81 |
OC(=O)C1CCCCC1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-728-873 |
0.81 |
O=c1cccc2C3CC(CN(C3)c3nc(NC4CCCCC4)nc(n3)N3CCCCC3)Cn12 |
|
| MolPort-001-746-586 |
0.81 |
CS(=O)(=O)NC[C@H]1C[C@@H]2CC[N@]1C[C@@H]2CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-989 |
0.81 |
OC(CNc1cccc(O)c1)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-003-182-335 |
0.81 |
CC(=O)Nc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-347-789 |
0.81 |
CC(C)C[C@@H](C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cccc1 |
|
| MolPort-001-905-867 |
0.81 |
COc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-044-566-344 |
0.81 |
O=C(NCCc1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-347-444 |
0.81 |
CC(C)CC(C(=O)N1CC2CC(C1)c1cccc(=O)n1C2)n1cccc1 |
|
| MolPort-039-347-444 |
0.81 |
CC(C)CC(C(=O)N1CC2CC(C1)c1cccc(=O)n1C2)n1cccc1 |
|
| MolPort-039-347-789 |
0.81 |
CC(C)C[C@@H](C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cccc1 |
|
| MolPort-039-194-026 |
0.81 |
O=C(NCCc1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-016-586-238 |
0.81 |
CC1(C)C2CC1C(CN1CC3CC(C1)c1cccc(=O)n1C3)=CC2 |
|
| MolPort-039-194-401 |
0.81 |
CC(C)C[C@H](C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cccc1 |
|
| MolPort-039-129-062 |
0.81 |
COCC(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-989 |
0.81 |
OC(CNc1cccc(O)c1)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-566-344 |
0.81 |
O=C(NCCc1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-001 |
0.81 |
Cl.CCS(=O)(=O)CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-026 |
0.81 |
O=C(NCCc1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-401 |
0.81 |
CC(C)C[C@H](C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cccc1 |
|
| MolPort-004-973-563 |
0.81 |
O=C(N1CC2CC(C1)c1cccc(=O)n1C2)c1ccncc1 |
|
| MolPort-003-757-708 |
0.81 |
OC(=O)CCCC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-005-909-332 |
0.81 |
OC(=O)CCCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-009-758-183 |
0.81 |
Cl.OC(CNc1ccc(O)cc1)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-000-751-705 |
0.81 |
[Cl-].OC(CNc1ccc(O)cc1)C[NH+]1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-027-838-277 |
0.80 |
CCC(=O)NC(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl |
|
| MolPort-002-511-420 |
0.80 |
Cc1cc(Cl)ccc1C(=O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-516-036 |
0.80 |
CC(C)(C)C(=O)NC(N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl |
|
| MolPort-002-519-164 |
0.80 |
OC(CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)Cn1c2ccc(Cl)cc2c2cc(Cl)ccc12 |
|
| MolPort-044-722-490 |
0.80 |
COc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)c2ccccc12 |
|
| MolPort-027-718-836 |
0.80 |
Cl.[O-][N+](=O)c1ccc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-016-586-270 |
0.80 |
CSc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-193-954 |
0.80 |
OC(CSCC=C)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-900 |
0.80 |
Oc1ccc(CCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-005-947-086 |
0.80 |
OC(=O)C[C@@H]1CCN(Cc2ccccc2)C[C@@H]1CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-027-718-538 |
0.80 |
CC(=O)Nc1ccc(cc1)C(=O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-015-137-383 |
0.80 |
OC(=O)C1C2CCC(C2)C1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-720-633 |
0.80 |
CC(C)Nc1nc(nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2)N1CCCC1 |
|
| MolPort-046-424-374 |
0.80 |
Cc1cc(Cl)ccc1C(=O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-516-049 |
0.80 |
CCC(=O)NC(N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl |
|
| MolPort-009-757-931 |
0.80 |
Cl.Clc1ccc(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1Cl |
|
| MolPort-000-740-673 |
0.80 |
[Cl-].Clc1ccc(C[NH+]2C[C@H]3CC(C2)c2cccc(=O)n2C3)cc1Cl |
|
| MolPort-002-160-220 |
0.80 |
COc1ccccc1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-004-831-600 |
0.80 |
CC(C)C(=O)NC(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl |
|
| MolPort-039-194-053 |
0.80 |
CC(C)(C)C(=O)NC(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl |
|
| MolPort-035-873-837 |
0.80 |
O=C(Cn1ccc2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-001-909-387 |
0.80 |
O=c1cccc2C3CC(CN(C3)c3nc(nc(n3)N3CCCC3)N3CCCC3)Cn12 |
|
| MolPort-002-026-032 |
0.80 |
Clc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1Cl |
|
| MolPort-002-516-068 |
0.80 |
CC(C)C(=O)NC(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl |
|
| MolPort-002-517-768 |
0.80 |
COCCOCC(O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-009-745-124 |
0.80 |
O=C(Cn1ccc2ccccc12)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-044-565-411 |
0.80 |
COCCOCC(O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-511-601 |
0.80 |
OC(CSCC=C)CN1CC2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-722-480 |
0.80 |
CCOC(=O)N1CCC(CC1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-160-290 |
0.80 |
Fc1ccc(F)c(CN2CC3CC(C2)c2cccc(=O)n2C3)c1 |
|
| MolPort-004-831-615 |
0.80 |
CC(=O)NC(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl |
|
| MolPort-016-586-279 |
0.80 |
Fc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)c(F)c1 |
|
| MolPort-046-454-448 |
0.80 |
CC(CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)=Cc1ccccc1 |
|
| MolPort-046-597-397 |
0.80 |
Fc1ccc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-044-565-411 |
0.80 |
COCCOCC(O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-424-374 |
0.80 |
Cc1cc(Cl)ccc1C(=O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-900 |
0.80 |
Oc1ccc(CCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-044-722-480 |
0.80 |
CCOC(=O)N1CCC(CC1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-035-873-837 |
0.80 |
O=C(Cn1ccc2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-027-718-836 |
0.80 |
Cl.[O-][N+](=O)c1ccc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-027-838-277 |
0.80 |
CCC(=O)NC(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl |
|
| MolPort-039-194-053 |
0.80 |
CC(C)(C)C(=O)NC(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl |
|
| MolPort-039-193-954 |
0.80 |
OC(CSCC=C)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-027-718-538 |
0.80 |
CC(=O)Nc1ccc(cc1)C(=O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-180-456 |
0.80 |
O=C(CC(c1ccccc1)n1cccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-641-215 |
0.80 |
Oc1ccc(O)c(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1 |
|
| MolPort-044-722-490 |
0.80 |
COc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)c2ccccc12 |
|
| MolPort-046-454-448 |
0.80 |
CC(CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)=Cc1ccccc1 |
|
| MolPort-002-160-246 |
0.80 |
Clc1cccc(Cl)c1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-046-597-210 |
0.80 |
[O-][N+](=O)c1ccc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-046-641-215 |
0.80 |
Oc1ccc(O)c(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1 |
|
| MolPort-016-586-258 |
0.80 |
C\C(CN1CC2CC(C1)c1cccc(=O)n1C2)=C/c1ccccc1 |
|
| MolPort-009-745-148 |
0.80 |
Fc1ccc(CC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-002-516-070 |
0.80 |
CC(=O)NC(N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl |
|
| MolPort-002-720-634 |
0.80 |
CC1CCN(CC1)c1nc(nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2)N1CCC(C)CC1 |
|
| MolPort-002-719-262 |
0.80 |
COC(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-044-180-456 |
0.80 |
O=C(CC(c1ccccc1)n1cccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-597-397 |
0.80 |
Fc1ccc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-046-597-210 |
0.80 |
[O-][N+](=O)c1ccc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-002-515-770 |
0.80 |
COC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-160-243 |
0.80 |
[O-][N+](=O)c1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-193-928 |
0.79 |
Fc1ccccc1CCNC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-005-910-792 |
0.79 |
O=C(CCC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)NCc1ccccc1 |
|
| MolPort-046-107-692 |
0.79 |
FC1(F)CCC(CC1)NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-057 |
0.79 |
CC(C)CC(=O)NC(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl |
|
| MolPort-002-509-684 |
0.79 |
Fc1ccccc1CCNC(=O)CCC(=O)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-188 |
0.79 |
CC(C)C(=O)Nc1ccc(cc1)C(=O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-001-912-430 |
0.79 |
Cc1ccc(cc1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-514-889 |
0.79 |
C=CCNC(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-005-971-820 |
0.79 |
O=C(CCCC(=O)N1CC2CC(C1)c1cccc(=O)n1C2)NCc1ccccc1 |
|
| MolPort-035-700-601 |
0.79 |
Cc1ccc(C)n1CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-068-041 |
0.79 |
Cc1cc(O)cc(=O)n1CCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-005-911-341 |
0.79 |
O=C(CCCC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)NCc1ccccc1 |
|
| MolPort-002-160-284 |
0.79 |
Clc1cccc(CN2CC3CC(C2)c2cccc(=O)n2C3)c1Cl |
|
| MolPort-000-821-043 |
0.79 |
OC(CN1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccc(cc1)[N+]([O-])=O |
|
| MolPort-039-193-960 |
0.79 |
OC(COCC#C)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-424-141 |
0.79 |
OC(COCC#C)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-160-245 |
0.79 |
[O-][N+](=O)c1ccccc1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-508-894 |
0.79 |
C[C@H](NC(=O)CCC(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccccc1 |
|
| MolPort-046-424-141 |
0.79 |
OC(COCC#C)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-068-041 |
0.79 |
Cc1cc(O)cc(=O)n1CCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-035-700-601 |
0.79 |
Cc1ccc(C)n1CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-960 |
0.79 |
OC(COCC#C)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-027-564-262 |
0.79 |
CC1(C)C(C1C(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)C(O)=O |
|
| MolPort-039-194-186 |
0.79 |
CC1(C)C(C1C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O |
|
| MolPort-039-194-188 |
0.79 |
CC(C)C(=O)Nc1ccc(cc1)C(=O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-027-718-301 |
0.79 |
CC(C)C(=O)Nc1ccc(cc1)C(=O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-027-718-376 |
0.79 |
COc1ccc(cc1)C(=O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-431-979 |
0.79 |
Clc1ccc(CC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-193-972 |
0.79 |
OC(=O)C(O)=O.O=c1cccc2[C@@H]3C[C@@H](CN(CC#Cc4ccccc4)C3)Cn12 |
|
| MolPort-039-194-057 |
0.79 |
CC(C)CC(=O)NC(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl |
|
| MolPort-035-701-269 |
0.79 |
Clc1ccc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-193-928 |
0.79 |
Fc1ccccc1CCNC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-107-692 |
0.79 |
FC1(F)CCC(CC1)NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-000-696-409 |
0.79 |
CC(O)=O.Fc1ccc(CCNC(=O)CCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-027-718-301 |
0.79 |
CC(C)C(=O)Nc1ccc(cc1)C(=O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-186 |
0.79 |
CC1(C)C(C1C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O |
|
| MolPort-004-831-624 |
0.79 |
CCCC(=O)NC(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl |
|
| MolPort-006-067-968 |
0.79 |
CC1(C)C(C1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2)C(O)=O |
|
| MolPort-002-160-277 |
0.79 |
[O-][N+](=O)c1cccc(CN2CC3CC(C2)c2cccc(=O)n2C3)c1 |
|
| MolPort-006-827-741 |
0.79 |
OCCNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-026-036 |
0.79 |
COc1ccc(cc1)C(=O)CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-000-857-567 |
0.79 |
C=CCNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-003-182-348 |
0.79 |
Clc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)c(Cl)c1 |
|
| MolPort-002-516-239 |
0.79 |
CC(C)CC(=O)NC(N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl |
|
| MolPort-002-516-208 |
0.79 |
CCCC(=O)NC(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl |
|
| MolPort-002-516-555 |
0.79 |
C=CCNC(=S)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-000-704-230 |
0.79 |
OC(=O)C([O-])=O.O=c1cccc2[C@H]3C[C@H](C[NH+](CC#Cc4ccccc4)C3)Cn12 |
|
| MolPort-005-910-188 |
0.79 |
CCN(CC)CCNC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-514-647 |
0.79 |
CN(C)c1ccc(cc1)C(C#N)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-044-431-979 |
0.79 |
Clc1ccc(CC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-000-817-694 |
0.79 |
[O-][N+](=O)c1cccc(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1 |
|
| MolPort-003-016-104 |
0.79 |
O=c1cccc2C3CC(CN(C3)C(=S)NC3Cc4ccccc4C3)Cn12 |
|
| MolPort-005-947-067 |
0.79 |
OC(=O)C[C@@H]1CCN(C[C@@H]1CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(=O)Cc1ccccc1 |
|
| MolPort-001-746-582 |
0.79 |
O=C(NC[C@H]1C[C@@H]2CC[N@]1C[C@@H]2CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccccc1 |
|
| MolPort-000-763-709 |
0.79 |
COc1ccc(NCC(O)CN2C[C@H]3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-027-564-262 |
0.79 |
CC1(C)C(C1C(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)C(O)=O |
|
| MolPort-027-718-376 |
0.79 |
COc1ccc(cc1)C(=O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-035-701-269 |
0.79 |
Clc1ccc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-002-517-386 |
0.79 |
CCCCOCC(O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-972 |
0.79 |
OC(=O)C(O)=O.O=c1cccc2[C@@H]3C[C@@H](CN(CC#Cc4ccccc4)C3)Cn12 |
|
| MolPort-002-508-845 |
0.79 |
O=C(CCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)NCc1ccccc1 |
|
| MolPort-016-586-251 |
0.79 |
COc1ccc2ccccc2c1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-533-614 |
0.79 |
C=CCNC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MCULE-6901792446 |
0.79 |
C1=C2OC(=CC(C2=C(O)C2=C1O[C@H](C(O)(C)C)C2)=O)C |
|
| MolPort-001-744-903 |
0.78 |
CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)C1CCCCC1 |
|
| MolPort-030-042-331 |
0.78 |
CSCCC(N)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-075-547 |
0.78 |
Cl.O=c1cccc2C3CC(CN(Cc4ccoc4)C3)Cn12 |
|
| MolPort-044-179-642 |
0.78 |
O=C(NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C1CN(C1)C(c1ccccc1)c1ccccc1 |
|
| MolPort-044-722-483 |
0.78 |
Fc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1Br |
|
| MolPort-039-193-907 |
0.78 |
COc1ccc(CC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-045-903-031 |
0.78 |
COc1cc(CN2CC3CC(C2)c2cccc(=O)n2C3)ccc1O |
|
| MolPort-044-566-763 |
0.78 |
Fc1cc(F)cc(CC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1 |
|
| MolPort-044-432-056 |
0.78 |
O=C(C1CN(C1)C(c1ccccc1)c1ccccc1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-046-065-969 |
0.78 |
Nc1ccccc1C(=O)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-911 |
0.78 |
O=C(CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)NCCCN1CCOCC1 |
|
| MolPort-035-873-440 |
0.78 |
CC(C)[C@H]1CC[C@@H](CC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-566-352 |
0.78 |
OC(COCC=C)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-035-874-148 |
0.78 |
O=C(C1CN(C1)C(c1ccccc1)c1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-027-718-021 |
0.78 |
Clc1ccc(C(=O)CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(Cl)c1 |
|
| MolPort-044-632-936 |
0.78 |
Cc1cccnc1CCNC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-056-699 |
0.78 |
O=C([C@@H](Cc1ccccc1)n1cccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-000-815-334 |
0.78 |
[O-][N+](=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-030-042-331 |
0.78 |
CSCCC(N)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-514-619 |
0.78 |
O=C(CN1C[C@@H]2CC(C1)c1cccc(=O)n1C2)OCC#C |
|
| MolPort-002-524-102 |
0.78 |
CN(C)S(=O)(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-513-049 |
0.78 |
OC(COCC=C)CN1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-005-974-630 |
0.78 |
Cc1ccc(NC(=O)CCCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-044-432-056 |
0.78 |
O=C(C1CN(C1)C(c1ccccc1)c1ccccc1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-044-566-352 |
0.78 |
OC(COCC=C)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-027-718-021 |
0.78 |
Clc1ccc(C(=O)CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(Cl)c1 |
|
| MolPort-035-874-148 |
0.78 |
O=C(C1CN(C1)C(c1ccccc1)c1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-001-905-866 |
0.78 |
COc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1O |
|
| MolPort-044-632-936 |
0.78 |
Cc1cccnc1CCNC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-075-547 |
0.78 |
Cl.O=c1cccc2C3CC(CN(Cc4ccoc4)C3)Cn12 |
|
| MolPort-039-056-699 |
0.78 |
O=C([C@@H](Cc1ccccc1)n1cccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-005-947-082 |
0.78 |
CC(C)NC(=O)N1CC[C@@H](CC(O)=O)[C@@H](CCN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)C1 |
|
| MolPort-005-976-870 |
0.78 |
Cc1ccc(NC(=O)CCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-002-508-573 |
0.78 |
O=C(CCCCCCCCCCC1CCCO1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-009-759-251 |
0.78 |
Nc1ccc(nc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-004-859-086 |
0.78 |
Cc1ccc(NC(=O)CCC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-005-947-083 |
0.78 |
OC(=O)C[C@@H]1CCN(C[C@@H]1CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(=O)NC1CCCCC1 |
|
| MolPort-016-617-917 |
0.78 |
Cc1ccccc1NC(=O)CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-911 |
0.78 |
O=C(CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)NCCCN1CCOCC1 |
|
| MolPort-002-026-029 |
0.78 |
CN(C)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-006-810-615 |
0.78 |
[Cl-].CC[S+]([O-])(=O)CC[NH+]1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-179-642 |
0.78 |
O=C(NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C1CN(C1)C(c1ccccc1)c1ccccc1 |
|
| MolPort-007-900-339 |
0.78 |
COC(=O)CCCC(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-016-622-924 |
0.78 |
CCOc1cccc(OCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1 |
|
| MolPort-045-903-031 |
0.78 |
COc1cc(CN2CC3CC(C2)c2cccc(=O)n2C3)ccc1O |
|
| MolPort-002-509-806 |
0.78 |
COc1ccc(CCNC(=O)CCC(=O)N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-193-907 |
0.78 |
COc1ccc(CC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-002-508-789 |
0.78 |
COc1ccc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-044-722-483 |
0.78 |
Fc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1Br |
|
| MolPort-044-566-763 |
0.78 |
Fc1cc(F)cc(CC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1 |
|
| MolPort-046-065-969 |
0.78 |
Nc1ccccc1C(=O)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-518-014 |
0.78 |
OC(COC1CCCCC1)CN1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-004-859-089 |
0.78 |
Cc1ccc(NC(=O)CCCC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-035-873-440 |
0.78 |
CC(C)[C@H]1CC[C@@H](CC1)C(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-009-745-151 |
0.77 |
O=C(C1CN(C(=O)C1)c1ccccc1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-035-874-073 |
0.77 |
O=C(C1CN(Cc2ccccc2)C(=O)C1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-005-947-065 |
0.77 |
COCC(=O)N1CC[C@@H](CC(O)=O)[C@@H](CCN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)C1 |
|
| MolPort-039-193-919 |
0.77 |
O=C(CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)NC(c1ccccc1)c1ccccc1 |
|
| MolPort-039-194-042 |
0.77 |
Cl.CC(C)(OC(=O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C#C |
|
| MolPort-042-645-892 |
0.77 |
O=C([C@@H](c1ccccc1)n1cccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-598-093 |
0.77 |
OC(COCc1ccccc1)C[NH+]1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-952 |
0.77 |
OC(CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)CS(=O)CC=C |
|
| MolPort-028-856-404 |
0.77 |
O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2[nH]ccc2c1 |
|
| MolPort-002-516-794 |
0.77 |
CC1CCC(CC1)(N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccccc1C |
|
| MolPort-016-586-275 |
0.77 |
COc1ccc(O)c(CN2CC3CC(C2)c2cccc(=O)n2C3)c1 |
|
| MolPort-042-645-892 |
0.77 |
O=C([C@@H](c1ccccc1)n1cccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-566-541 |
0.77 |
Oc1ccc(Br)cc1CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-518-510 |
0.77 |
Oc1ccc(Br)cc1CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-004-831-604 |
0.77 |
ClC(Cl)(Cl)C(NC(=O)Cc1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-045-968-452 |
0.77 |
CCCCOc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-019-624-564 |
0.77 |
O=C1N(CCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(=O)c2ccccc12 |
|
| MolPort-007-980-942 |
0.77 |
Oc1ccc(Br)cc1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-016-586-240 |
0.77 |
O=c1cccc2C3CC(CN(Cc4cccs4)C3)Cn12 |
|
| MolPort-002-516-097 |
0.77 |
ClC(Cl)(Cl)C(NC(=O)Cc1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-597-065 |
0.77 |
Brc1ccc2ccn(CCC(=O)N3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1 |
|
| MolPort-035-700-494 |
0.77 |
CCOc1ccc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-193-931 |
0.77 |
OC(COCc1ccccc1)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-027-849-440 |
0.77 |
OC(COCc1ccccc1)CN1CC2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-597-655 |
0.77 |
O=C(C1CN(C(=O)C1)c1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-597-401 |
0.77 |
O=C(C1CN(Cc2ccccc2)C(=O)C1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-035-874-073 |
0.77 |
O=C(C1CN(Cc2ccccc2)C(=O)C1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-919 |
0.77 |
O=C(CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)NC(c1ccccc1)c1ccccc1 |
|
| MolPort-028-856-404 |
0.77 |
O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2[nH]ccc2c1 |
|
| MolPort-044-179-428 |
0.77 |
COc1ccc(CC(=O)NCCN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-193-930 |
0.77 |
COc1ccc(CCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-075-548 |
0.77 |
Cl.O=c1cccc2C3CC(CN(Cc4ccsc4)C3)Cn12 |
|
| MolPort-027-718-777 |
0.77 |
O=C(CCCCC1CCSS1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-035-701-147 |
0.77 |
O=C(CCCCCNc1ncccn1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-424-450 |
0.77 |
OC(COc1ccccc1)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-566-541 |
0.77 |
Oc1ccc(Br)cc1CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-045-968-452 |
0.77 |
CCCCOc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-193-931 |
0.77 |
OC(COCc1ccccc1)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-932 |
0.77 |
OC(COc1ccccc1)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-932 |
0.77 |
OC(COc1ccccc1)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-597-655 |
0.77 |
O=C(C1CN(C(=O)C1)c1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-510-139 |
0.77 |
OC(COc1ccccc1)CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-514-974 |
0.77 |
CC(C)(OC(=O)CN1C[C@H]2CC(C1)c1cccc(=O)n1C2)C#C |
|
| MolPort-002-514-757 |
0.77 |
COc1ccc(cc1)C(C#N)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-514-718 |
0.77 |
OC(=O)\C=C\C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-005-909-663 |
0.77 |
O=C(CCc1nc2ccccc2[nH]1)N1CC2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-179-428 |
0.77 |
COc1ccc(CC(=O)NCCN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-002-160-214 |
0.77 |
COc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)c(O)c1 |
|
| MolPort-027-718-777 |
0.77 |
O=C(CCCCC1CCSS1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-597-401 |
0.77 |
O=C(C1CN(Cc2ccccc2)C(=O)C1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-006-318-994 |
0.77 |
OC(=O)CCCCCNC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-512-242 |
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CC1(C)CC(CCO1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-512-953 |
0.77 |
COc1ccccc1NCC(O)CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-035-701-147 |
0.77 |
O=C(CCCCCNc1ncccn1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-004-975-618 |
0.77 |
FC(F)(F)c1ccc(NC(=O)CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-005-976-402 |
0.77 |
COCCNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-507-259 |
0.77 |
OC(=O)CCCCCNC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-027-849-440 |
0.77 |
OC(COCc1ccccc1)CN1CC2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-533-791 |
0.77 |
O=C(CCc1nc2ccccc2[nH]1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-009-745-057 |
0.77 |
Clc1ccc(cc1)C(=O)CCC(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-000-822-222 |
0.77 |
[Cl-].CSCC[C@H]([NH3+])C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-035-700-494 |
0.77 |
CCOc1ccc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-194-042 |
0.77 |
Cl.CC(C)(OC(=O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C#C |
|
| MolPort-039-193-930 |
0.77 |
COc1ccc(CCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-046-597-065 |
0.77 |
Brc1ccc2ccn(CCC(=O)N3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1 |
|
| MolPort-039-193-952 |
0.77 |
OC(CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)CS(=O)CC=C |
|
| MolPort-002-084-534 |
0.77 |
COc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1OC |
|
| MolPort-005-910-568 |
0.77 |
Brc1ccc2ccn(CCC(=O)N3C[C@@H]4CC(C3)c3cccc(=O)n3C4)c2c1 |
|
| MolPort-005-910-195 |
0.77 |
COCCNC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-084-533 |
0.77 |
COc1cccc(CN2CC3CC(C2)c2cccc(=O)n2C3)c1O |
|
| MolPort-046-598-093 |
0.77 |
OC(COCc1ccccc1)C[NH+]1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-000-719-967 |
0.77 |
[Cl-].CC(C)(OC(=O)C[NH+]1C[C@H]2CC(C1)c1cccc(=O)n1C2)C#C |
|
| MolPort-002-026-028 |
0.77 |
CS(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-009-745-123 |
0.77 |
O=C(N1CC2CC(C1)c1cccc(=O)n1C2)c1ccc(cc1)-n1cccc1 |
|
| MolPort-046-424-450 |
0.77 |
OC(COc1ccccc1)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-075-548 |
0.77 |
Cl.O=c1cccc2C3CC(CN(Cc4ccsc4)C3)Cn12 |
|
| MolPort-009-653-439 |
0.77 |
Cl.CSCC[C@H](N)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-509-886 |
0.76 |
O=C(CCCCCCCCCCC1COCCO1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-026-005 |
0.76 |
O=c1cccc2C3CC(CN(C3)C(=S)NCc3ccccc3)Cn12 |
|
| MolPort-028-855-283 |
0.76 |
Clc1ccc(cc1)C(CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)Cn1cccc1 |
|
| MolPort-039-194-128 |
0.76 |
CC(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccccc1 |
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| MolPort-016-586-271 |
0.76 |
COc1ccc(OC)c(CN2CC3CC(C2)c2cccc(=O)n2C3)c1 |
|
| MolPort-004-975-458 |
0.76 |
Fc1ccc(CNC(=O)CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-002-741-880 |
0.76 |
CC(NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccccc1 |
|
| MolPort-028-854-798 |
0.76 |
O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2cc[nH]c2c1 |
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| MolPort-000-752-528 |
0.76 |
[Cl-].OC(COCc1ccccc1)C[NH+]1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-566-597 |
0.76 |
O=C(NCc1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-035-701-589 |
0.76 |
O=C(CCCNc1ncccn1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-154 |
0.76 |
CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2ccc(CC3(CN4C[C@@H]5C[C@@H](C4)c4cccc(=O)n4C5)C(=O)N(C)C(=O)N(C)C3=O)cc2)C1=O |
|
| MolPort-046-596-878 |
0.76 |
CC(C)c1ccc(CC2(CN3CC4CC(C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)cc1 |
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| MolPort-046-597-554 |
0.76 |
O=C(C1CCN(CC1)c1ncccn1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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0.76 |
COc1ccc(OCC(O)CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
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| MolPort-039-194-019 |
0.76 |
O=C(NCc1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-941 |
0.76 |
O=c1cccc2[C@@H]3C[C@@H](CN(C3)C(=S)Nc3ccccc3)Cn12 |
|
| MolPort-035-873-971 |
0.76 |
Cc1cccc2n(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12 |
|
| MolPort-039-193-991 |
0.76 |
CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(C)cc2)C1=O |
|
| MolPort-039-193-905 |
0.76 |
Fc1ccc(CNC(=O)CCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-035-874-027 |
0.76 |
COc1ccc2n(CCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc2c1 |
|
| MolPort-035-701-589 |
0.76 |
O=C(CCCNc1ncccn1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-075-549 |
0.76 |
Cl.O=c1cccc2C3CC(CN(Cc4ccco4)C3)Cn12 |
|
| MolPort-046-423-650 |
0.76 |
OC(CSCc1ccccc1)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-180-530 |
0.76 |
CC(C)Oc1ccc(CCC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-044-566-597 |
0.76 |
O=C(NCc1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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| MolPort-035-873-936 |
0.76 |
O=C(C1CCN(CC1)c1ncccn1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-949 |
0.76 |
OC(CSCc1ccccc1)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-945 |
0.76 |
CC1(C)CC(CCO1)NC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-035-701-797 |
0.76 |
CC(C)Oc1ccc(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-075-550 |
0.76 |
Cl.O=c1cccc2C3CC(CN(Cc4cccs4)C3)Cn12 |
|
| MolPort-035-874-243 |
0.76 |
Clc1cccc2n(CCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12 |
|
| MolPort-044-722-498 |
0.76 |
O=c1cccc2C3CC(CN(Cc4ccco4)C3)Cn12 |
|
| MolPort-028-854-798 |
0.76 |
O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2cc[nH]c2c1 |
|
| MolPort-039-193-909 |
0.76 |
COc1ccccc1CCNC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-179-832 |
0.76 |
O=C(CCCCC1CCSS1)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-027-718-514 |
0.76 |
O=c1cccc2[C@H]3C[C@H](CN(Cc4nc5ccccc5c(=O)[nH]4)C3)Cn12 |
|
| MolPort-039-194-128 |
0.76 |
CC(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccccc1 |
|
| MolPort-044-432-026 |
0.76 |
CC(C)Oc1ccc(CCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-035-764-997 |
0.76 |
Cl.COc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1OC |
|
| MolPort-045-903-046 |
0.76 |
O=c1cccc2C3CC(CN(Cc4ccc(OCc5ccccc5)cc4)C3)Cn12 |
|
| MolPort-044-565-083 |
0.76 |
ClC(Cl)(Cl)C(NC(=O)Cc1cccc2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-028-855-283 |
0.76 |
Clc1ccc(cc1)C(CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)Cn1cccc1 |
|
| MolPort-044-564-007 |
0.76 |
CCOc1ccc(CC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MCULE-6090574411 |
0.76 |
C1(C2C=CC=CC=2)=COC2=C(C=C(C(OC)=C2)CCCC)C1=O |
|
| MCULE-6016168587 |
0.76 |
C1(C2=CC=CC=C2)=COC2=C(C=C(C(OC(C)=O)=C2)CCCC)C1=O |
|
| MolPort-002-513-192 |
0.76 |
COc1cccc(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1OC |
|
| MolPort-039-193-941 |
0.76 |
O=c1cccc2[C@@H]3C[C@@H](CN(C3)C(=S)Nc3ccccc3)Cn12 |
|
| MolPort-002-026-034 |
0.76 |
Fc1cccc(Cl)c1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-949 |
0.76 |
OC(CSCc1ccccc1)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-075-549 |
0.76 |
Cl.O=c1cccc2C3CC(CN(Cc4ccco4)C3)Cn12 |
|
| MolPort-016-586-256 |
0.76 |
COc1cccc(CN2CC3CC(C2)c2cccc(=O)n2C3)c1OC |
|
| MolPort-002-514-181 |
0.76 |
O=C(NCc1ccccc1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-019 |
0.76 |
O=C(NCc1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-513-485 |
0.76 |
CN1C(=O)N(C)C(=O)C(CN2CC3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(C)cc2)C1=O |
|
| MolPort-002-518-916 |
0.76 |
COc1ccc(OCC(O)CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-194-154 |
0.76 |
CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2ccc(CC3(CN4C[C@@H]5C[C@@H](C4)c4cccc(=O)n4C5)C(=O)N(C)C(=O)N(C)C3=O)cc2)C1=O |
|
| MolPort-002-509-836 |
0.76 |
CC(C)c1ccc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)cc1 |
|
| MolPort-015-136-136 |
0.76 |
OC(=O)CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-991 |
0.76 |
CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(C)cc2)C1=O |
|
| MolPort-035-873-936 |
0.76 |
O=C(C1CCN(CC1)c1ncccn1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-046-596-878 |
0.76 |
CC(C)c1ccc(CC2(CN3CC4CC(C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)cc1 |
|
| MolPort-046-423-650 |
0.76 |
OC(CSCc1ccccc1)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-597-554 |
0.76 |
O=C(C1CCN(CC1)c1ncccn1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-564-451 |
0.76 |
COc1ccc(OCC(O)CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-044-180-530 |
0.76 |
CC(C)Oc1ccc(CCC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-009-757-885 |
0.76 |
Cl.Fc1cccc(Cl)c1CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-001-738-755 |
0.76 |
CN1C(=O)N(C)C(=O)C(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2c3ccccc3cc3ccccc23)C1=O |
|
| MolPort-002-509-511 |
0.76 |
CN1C(=O)N(C)C(=O)C(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2cccc3ccccc23)C1=O |
|
| MolPort-004-998-451 |
0.76 |
Cc1ccccc1C1(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)CC(=O)N(C2CC2)C1=O |
|
| MolPort-035-874-027 |
0.76 |
COc1ccc2n(CCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc2c1 |
|
| MolPort-002-516-217 |
0.76 |
O=c1cccc2[C@H]3C[C@H](CN(C3)C(=S)NCc3ccccc3)Cn12 |
|
| MolPort-045-903-046 |
0.76 |
O=c1cccc2C3CC(CN(Cc4ccc(OCc5ccccc5)cc4)C3)Cn12 |
|
| MolPort-035-764-997 |
0.76 |
Cl.COc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1OC |
|
| MolPort-009-758-184 |
0.76 |
Cl.OC(COCc1ccccc1)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-075-550 |
0.76 |
Cl.O=c1cccc2C3CC(CN(Cc4cccs4)C3)Cn12 |
|
| MolPort-002-531-069 |
0.76 |
CC(C)(C)OC(=O)N1CCC(CC1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
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0.76 |
CC(C)(C)OC(=O)NCCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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0.76 |
CC(C)Oc1ccc(CCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-003-182-345 |
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COc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)c(OC)c1 |
|
| MolPort-002-516-574 |
0.76 |
ClC(Cl)(Cl)C(NC(=O)Cc1cccc2ccccc12)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-564-007 |
0.76 |
CCOc1ccc(CC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
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0.76 |
CN1C(=O)N(C)C(=O)C(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(CC3(CN4C[C@H]5C[C@H](C4)c4cccc(=O)n4C5)C(=O)N(C)C(=O)N(C)C3=O)cc2)C1=O |
|
| MolPort-002-725-716 |
0.76 |
Fc1ccc(cc1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-004-975-628 |
0.76 |
CCOC(=O)CNC(=O)CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-044-565-083 |
0.76 |
ClC(Cl)(Cl)C(NC(=O)Cc1cccc2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-027-718-514 |
0.76 |
O=c1cccc2[C@H]3C[C@H](CN(Cc4nc5ccccc5c(=O)[nH]4)C3)Cn12 |
|
| MolPort-005-947-089 |
0.76 |
OC(=O)C[C@@H]1CCN(Cc2ccc(F)cc2)C[C@@H]1CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-005-084-029 |
0.76 |
CCN1C(=O)CC(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(C1=O)c1ccccc1C |
|
| MolPort-039-193-909 |
0.76 |
COc1ccccc1CCNC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-001-746-598 |
0.76 |
COCCNC(=S)NC[C@H]1C[C@@H]2CC[N@]1C[C@@H]2CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-179-832 |
0.76 |
O=C(CCCCC1CCSS1)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-160-282 |
0.76 |
Oc1ccc(Cl)cc1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-035-701-797 |
0.76 |
CC(C)Oc1ccc(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-044-722-498 |
0.76 |
O=c1cccc2C3CC(CN(Cc4ccco4)C3)Cn12 |
|
| MolPort-035-874-243 |
0.76 |
Clc1cccc2n(CCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12 |
|
| MolPort-035-873-971 |
0.76 |
Cc1cccc2n(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12 |
|
| MolPort-002-519-481 |
0.76 |
Cc1ccc(OCC(O)CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-000-725-837 |
0.76 |
O=c1cccc2C3CC(CN(C3)C(=S)Nc3ccccc3)Cn12 |
|
| MolPort-000-731-225 |
0.76 |
[Cl-].Fc1cccc(Cl)c1C[NH+]1C[C@@H]2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-016-586-522 |
0.76 |
CCCCCCOc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-005-947-087 |
0.76 |
OC(=O)C[C@@H]1CCN(Cc2ccccc2O)C[C@@H]1CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-001-746-585 |
0.76 |
CN(C)c1ccc(cc1)C(=O)NC[C@H]1C[C@@H]2CC[N@]1C[C@@H]2CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-508-667 |
0.76 |
Fc1ccc(CNC(=O)CCC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-193-905 |
0.76 |
Fc1ccc(CNC(=O)CCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-193-945 |
0.76 |
CC1(C)CC(CCO1)NC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-511-138 |
0.76 |
CC1(C)CC(CCO1)NC(=O)CCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-563-993 |
0.75 |
O=C(NCCN1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)C1CCN(CC1)c1ncccn1 |
|
| MolPort-023-311-485 |
0.75 |
OC(=O)CNC(=O)N1CC2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-041 |
0.75 |
O=c1cccc2[C@@H]3C[C@@H](CN(C3)C(=S)Nc3cccc4ccccc34)Cn12 |
|
| MolPort-035-873-674 |
0.75 |
Cn1ccc2ccc(cc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-180-441 |
0.75 |
COc1ccc2n(CCC(=O)NCCN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc2c1 |
|
| MolPort-044-728-687 |
0.75 |
Clc1ccc(cc1)C(CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cccc1 |
|
| MolPort-035-700-478 |
0.75 |
O=C(CNC(=O)c1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-035-873-286 |
0.75 |
CC(C)n1ccc2ccc(cc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-596-848 |
0.75 |
Fc1ccccc1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-056-019 |
0.75 |
O=C(CCCc1nc2ccccc2c(=O)[nH]1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-047 |
0.75 |
OC(CSc1ccccc1)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-566-766 |
0.75 |
O=C(NCCN1CC2CC(C1)c1cccc(=O)n1C2)C1CCN(CC1)c1ncccn1 |
|
| MolPort-044-179-804 |
0.75 |
O=C(NCCN1CC2CC(C1)c1cccc(=O)n1C2)C1CCC(Cn2cnnn2)CC1 |
|
| MolPort-046-424-656 |
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CC12CCCC3(CO3)C1CC1C(C2)OC(=O)C1CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-768-551 |
0.75 |
Cl.O=C1CCCN1c1ccc(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-046-106-775 |
0.75 |
O=C(C1CCCN1c1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-007-931-547 |
0.75 |
CCC1CCCCN1CCCNC(=O)CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-343-014 |
0.75 |
COc1ccc(NC(=O)CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-044-543-565 |
0.75 |
O=C(C1CCC(Cn2cnnn2)CC1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-040-602-335 |
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CC(C)(CNC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C1=CCCC1 |
|
| MolPort-002-160-289 |
0.75 |
Oc1c(Br)cc(Br)cc1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-046-596-848 |
0.75 |
Fc1ccccc1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-512-672 |
0.75 |
C[C@]12CCCC3(CO3)C1C[C@H]1[C@@H](C2)OC(=O)C1CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-498-146 |
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FC(F)(F)S(=O)c1ccc(cc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-007-931-554 |
0.75 |
O=C(CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)NC1CCCCCCC1 |
|
| MolPort-002-525-653 |
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C[C@]12CCCC3(CO3)[C@@H]1C[C@H]1[C@@H](C2)OC(=O)C1CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-179-804 |
0.75 |
O=C(NCCN1CC2CC(C1)c1cccc(=O)n1C2)C1CCC(Cn2cnnn2)CC1 |
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| MolPort-046-424-656 |
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CC12CCCC3(CO3)C1CC1C(C2)OC(=O)C1CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-056-783 |
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CN1C(C(CC1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccccc1 |
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| MolPort-001-746-583 |
0.75 |
FC(F)(F)c1ccc(cc1)C(=O)NC[C@H]1C[C@@H]2CC[N@]1C[C@@H]2CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-056-783 |
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CN1C(C(CC1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccccc1 |
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| MolPort-002-522-656 |
0.75 |
Clc1ccc(NC(=O)CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1Cl |
|
| MolPort-046-498-146 |
0.75 |
FC(F)(F)S(=O)c1ccc(cc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-566-272 |
0.75 |
CC1(C)C(C=C(Cl)Cl)C1C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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| MolPort-002-507-255 |
0.75 |
OC(=O)CNC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-003-757-745 |
0.75 |
OC(=O)CNC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-566-272 |
0.75 |
CC1(C)C(C=C(Cl)Cl)C1C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-513-075 |
0.75 |
O=C(Nc1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-728-769 |
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CCNc1nc(Cl)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-044-566-766 |
0.75 |
O=C(NCCN1CC2CC(C1)c1cccc(=O)n1C2)C1CCN(CC1)c1ncccn1 |
|
| MolPort-002-514-952 |
0.75 |
O=c1cccc2C3C[C@@H](CN(C3)C(=S)Nc3cccc4ccccc34)Cn12 |
|
| MolPort-009-745-158 |
0.75 |
CS(=O)(=O)N1CCC(CC1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-005-310-069 |
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Brc1cc(Br)c(NC(=O)CN2CC3CC(C2)c2cccc(=O)n2C3)c(Br)c1 |
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| MolPort-039-343-014 |
0.75 |
COc1ccc(NC(=O)CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-002-728-396 |
0.75 |
Clc1nc(NC2CCCCC2)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-005-947-072 |
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OC(=O)C[C@@H]1CCN(C[C@@H]1CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(=O)c1ccccc1 |
|
| MolPort-046-768-551 |
0.75 |
Cl.O=C1CCCN1c1ccc(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-001-746-602 |
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O=c1cccc2[C@@H]3C[C@@H](CN(C[C@H]4C[N@@]5CC[C@H]4C[C@@H]5CNC(=S)Nc4ccccc4)C3)Cn12 |
|
| MolPort-046-106-775 |
0.75 |
O=C(C1CCCN1c1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-001-746-600 |
0.75 |
O=c1cccc2[C@@H]3C[C@@H](CN(C[C@H]4C[N@@]5CC[C@H]4C[C@@H]5CNC(=S)NCCN4CCOCC4)C3)Cn12 |
|
| MolPort-040-602-335 |
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CC(C)(CNC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C1=CCCC1 |
|
| MolPort-005-910-042 |
0.75 |
O=c1cccc2[C@H]3C[C@@H](CN(C3)C(=S)NCCCN3CCOCC3)Cn12 |
|
| MolPort-044-543-565 |
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O=C(C1CCC(Cn2cnnn2)CC1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-008-347-020 |
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Brc1ccc2n(CC(=O)N3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc2c1 |
|
| MolPort-006-827-662 |
0.75 |
[O-][N+](=O)c1ccc(NC(=O)CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-044-563-993 |
0.75 |
O=C(NCCN1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)C1CCN(CC1)c1ncccn1 |
|
| MolPort-016-589-993 |
0.75 |
OC(=O)CNC(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-044-728-687 |
0.75 |
Clc1ccc(cc1)C(CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cccc1 |
|
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0.75 |
Cn1ccc2ccc(cc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-047 |
0.75 |
OC(CSc1ccccc1)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-001-844-380 |
0.75 |
O=C(Nc1ccccc1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-056-019 |
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O=C(CCCc1nc2ccccc2c(=O)[nH]1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-041 |
0.75 |
O=c1cccc2[C@@H]3C[C@@H](CN(C3)C(=S)Nc3cccc4ccccc34)Cn12 |
|
| MolPort-002-522-045 |
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CC1(C)C(C=C(Cl)Cl)C1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-160-260 |
0.75 |
COc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1Br |
|
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0.75 |
COc1ccc2n(CCC(=O)NCCN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc2c1 |
|
| MolPort-035-873-286 |
0.75 |
CC(C)n1ccc2ccc(cc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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Fc1ccccc1C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-023-311-485 |
0.75 |
OC(=O)CNC(=O)N1CC2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-035-700-478 |
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O=C(CNC(=O)c1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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| MolPort-002-518-143 |
0.75 |
OC(=O)CCNC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-008-383-431 |
0.75 |
C=CCOc1ccccc1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MCULE-2185072336 |
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C1(O)C=C2OC=C(C3C=C4CCC(C)(C)OC4=CC=3)C(=O)C2=CC=1 |
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| MCULE-7013333859 |
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C1(C2C=CC(=CC=2)OC(C)C)=COC2=C(C=C(C(OC)=C2)CC)C1=O |
|
| MCULE-9740213223 |
0.75 |
C1(C2=CC=C(OC)C=C2)C(=O)OC2C(=C(OC)C3=C(OC(CC3)(C)C)C=2)C=1O |
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| MCULE-8066103607 |
0.75 |
C12OC(CO)=CC(=O)C=1C(O)=C1C[C@@H](C(C)(O)C)OC1=C2 |
|
| MCULE-5692701971 |
0.75 |
C1(C2=CC=CC=C2)=COC2C(=CC=C(OCCCC3C=CC=CC=3)C=2)C1=O |
|
| MolPort-002-509-060 |
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COc1ccc(CCNC(=O)CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1OC |
|
| MolPort-002-522-504 |
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COC(=O)CCCCCNC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
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COc1ccc(CCNC(=O)CCC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1OC |
|
| MolPort-001-744-378 |
0.74 |
O=c1ccc(-c2ccccc2)c2[C@@H]3C[C@@H](CN(CC4CCCCC4)C3)Cn12 |
|
| MolPort-039-194-028 |
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CCCCC[C@H](O)\C=C\[C@H]1CCC(=O)[C@@H]1CCCCCCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-000-847-002 |
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CC(C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2c(c1)[nH]c1ccc(Cl)cc21 |
|
| MolPort-044-181-212 |
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O=C(CCc1nc2ccccc2c(=O)[nH]1)NCCN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-345-638 |
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Brc1ccc2ccn(CC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)c2c1 |
|
| MolPort-039-194-100 |
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Clc1ccccc1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-045-968-449 |
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Cc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)o1 |
|
| MolPort-046-598-112 |
0.74 |
O=c1cccc2C3C[C@@H](CN(C3)C(=S)Nc3ccc4cnccc4c3)Cn12 |
|
| MolPort-035-700-894 |
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O=C(CCCn1cccn1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-007-931-534 |
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CCC(C)NC(=O)CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-016-589-754 |
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CC(NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2)C(O)=O |
|
| MolPort-046-597-265 |
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COc1ccc(cc1OC)C(=O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-347-821 |
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C[C@H](NC(=O)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2)C(O)=O |
|
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Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O |
|
| MolPort-044-566-762 |
0.74 |
FC(F)(F)Oc1ccc(CC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-009-745-058 |
0.74 |
Clc1ccccc1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-057-715 |
0.74 |
O=C(C1CCCN(C1)c1ncccn1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-003-182-891 |
0.74 |
Oc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1[N+]([O-])=O |
|
| MolPort-027-718-732 |
0.74 |
Cl.COc1ccc(cc1OC)C(=O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-003-186-719 |
0.74 |
C=COCCNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-035-873-395 |
0.74 |
Clc1cccc2n(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12 |
|
| MolPort-035-874-098 |
0.74 |
O=C(CCN1Cc2ccccc2C1=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-042-672-009 |
0.74 |
COc1ccc(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1OC |
|
| MolPort-003-182-334 |
0.74 |
Oc1ccc(cc1CN1CC2CC(C1)c1cccc(=O)n1C2)[N+]([O-])=O |
|
| MolPort-002-535-465 |
0.74 |
O=C(\C=C\c1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-027-838-589 |
0.74 |
Brc1cccc2n(CC(=O)N3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12 |
|
| MolPort-007-931-543 |
0.74 |
CC1CC(C)CN(C1)C(=O)CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-046-597-498 |
0.74 |
O=C(CCN1Cc2ccccc2C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-432-052 |
0.74 |
Clc1ccc2ccn(CC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)c2c1 |
|
| MolPort-044-432-051 |
0.74 |
Clc1cccc2n(CC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)ccc12 |
|
| MolPort-028-856-312 |
0.74 |
O=C(CCc1c[nH]c2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-035-874-180 |
0.74 |
Clc1ccc2ccn(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1 |
|
| MolPort-002-167-535 |
0.74 |
Oc1ccc(c(CN2CC3CC(C2)c2cccc(=O)n2C3)c1)[N+]([O-])=O |
|
| MolPort-002-507-256 |
0.74 |
CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O |
|
| MolPort-002-514-955 |
0.74 |
CC(C)CC(NC(=O)c1ccccc1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-007-931-552 |
0.74 |
O=C(CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)NCCCN1CCCCC1 |
|
| MolPort-016-586-253 |
0.74 |
COc1ccc(Br)cc1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-035-873-946 |
0.74 |
COc1cccc2n(CCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12 |
|
| MolPort-044-179-658 |
0.74 |
O=C(CCCc1c[nH]c2ccccc12)NCCN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-046-068-635 |
0.74 |
Cc1cc(O)cc(=O)n1CC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-007-931-540 |
0.74 |
CCCN(CCC)CCCNC(=O)CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-007-931-527 |
0.74 |
CC1CCN(CC1)C(=O)CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-046-424-058 |
0.74 |
Brc1cccc2n(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12 |
|
| MolPort-007-931-533 |
0.74 |
CC(C)CCNC(=O)CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-006-317-102 |
0.74 |
O=C(\C=C\c1ccccc1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-044-179-809 |
0.74 |
O=C(NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C1(CCOCC1)c1ccccc1 |
|
| MolPort-044-811-323 |
0.74 |
Brc1cccc2n(CC(=O)N3C[C@@H]4CC(C3)c3cccc(=O)n3C4)ccc12 |
|
| MolPort-006-316-353 |
0.74 |
CC(C)[C@@H](NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O |
|
| MolPort-007-931-556 |
0.74 |
CCCCNC(=O)CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-046-424-538 |
0.74 |
Cc1cc(O)cc(=O)n1CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-008-348-687 |
0.74 |
Brc1cccc2n(CC(=O)N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)ccc12 |
|
| MolPort-039-193-929 |
0.74 |
FC(F)(F)c1cccc(c1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-511-468 |
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FC(F)(F)c1cccc(CNC(=O)CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1 |
|
| MolPort-039-343-016 |
0.74 |
CCOc1ccc(NC(=O)CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-057-907 |
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O=C(CCCCCN1Cc2ccccc2C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-056-827 |
0.74 |
COc1ccccc1CCN1CC(CC1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-001-746-594 |
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O=C(NC[C@H]1C[C@@H]2CC[N@]1C[C@@H]2CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)Nc1ccccc1 |
|
| MolPort-039-009-489 |
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CCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(N)c1 |
|
| MolPort-002-511-967 |
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CC1(C)CC(CC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(CCO1)c1ccccc1 |
|
| MolPort-007-931-541 |
0.74 |
CC1CCCC(NC(=O)CNC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)C1C |
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| MolPort-005-971-070 |
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COc1ccc(NC(=O)CCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
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| MolPort-005-911-153 |
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COc1ccc(NC(=O)CCC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
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| MolPort-044-432-108 |
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O=C(CCCCCN1Cc2ccccc2C1=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-007-931-536 |
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CC1CCC(CC1)NC(=O)CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
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| MolPort-039-193-951 |
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FC(F)(F)c1cccc(CNC(=O)CCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1 |
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| MolPort-005-946-292 |
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CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc4ccccc4c3)c(=O)n1C2 |
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CN(C)c1ccc(NC(=S)NC[C@H]2C[C@@H]3CC[N@]2C[C@@H]3CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
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| MolPort-002-517-173 |
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Clc1ccccc1C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-009-745-127 |
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CN(C)c1cccc(c1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
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| MolPort-039-193-990 |
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Cc1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
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| MolPort-001-743-729 |
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CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccnc3)c(=O)n1C2 |
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| MolPort-004-975-444 |
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Cc1ccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-002-519-119 |
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C[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O |
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| MolPort-039-193-970 |
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O=C(CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1c[nH]c2ccccc12 |
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| MolPort-028-855-051 |
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O=C(CCCc1c[nH]c2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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| MolPort-001-743-267 |
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O=c1c(ccc2[C@H]3CNC[C@H](C3)Cn12)-c1ccc2ccccc2c1 |
|
| MolPort-002-507-525 |
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C[C@H](NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O |
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| MolPort-027-838-572 |
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Brc1ccc2ccn(CC(=O)N3C[C@@H]4CC(C3)c3cccc(=O)n3C4)c2c1 |
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| MolPort-035-701-739 |
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CCNC(=O)c1ccc(N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(N)c1 |
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| MolPort-002-509-479 |
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O=C(COc1ccccc1)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 |
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| MolPort-007-931-537 |
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CC1CCCCC1NC(=O)CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-027-718-858 |
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Cn1c2ccccc2cc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1=O |
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| MolPort-039-195-008 |
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O=C(CC1(CCSCC1)n1cccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
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| MolPort-016-586-250 |
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CCOc1cccc(CN2CC3CC(C2)c2cccc(=O)n2C3)c1O |
|
| MolPort-039-193-920 |
0.74 |
O=C(COc1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
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| MolPort-046-595-497 |
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[O-][N+](=O)c1ccc2C3CNCC(C3)Cn2c1=O |
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| MolPort-042-646-419 |
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[O-][N+](=O)c1ccc2[C@@H]3CNC[C@@H](C3)Cn2c1=O |
|
| MolPort-046-454-447 |
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CCn1c(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)nc2ccccc12 |
|
| MolPort-019-880-451 |
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Fc1ccc2ccn(CC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)c2c1 |
|
| MolPort-000-761-781 |
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CN1C(=S)N(C)C(=O)C(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2c3ccccc3cc3ccccc23)C1=O |
|
| MolPort-002-517-985 |
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CCCCNC(=O)[C@@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(C)C |
|
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O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cccc2[nH]ccc12 |
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| MolPort-045-946-995 |
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O=C(CCn1cnc2ccccc12)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-722-488 |
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Oc1c(Cl)cc(Cl)cc1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-512-806 |
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OC(CC#CCN1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)(c1ccccc1)c1ccccc1 |
|
| MolPort-044-810-022 |
0.74 |
[O-][N+](=O)c1ccc2[C@@H]3CNC[C@H](C3)Cn2c1=O |
|
| MolPort-027-838-590 |
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Fc1ccc2ccn(CC(=O)N3C[C@@H]4CC(C3)c3cccc(=O)n3C4)c2c1 |
|
| MolPort-045-903-048 |
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Cc1nc[nH]c1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-514-791 |
0.74 |
CN1C(=S)N(C)C(=O)C(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2cccc3ccccc23)C1=O |
|
| MolPort-003-716-449 |
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O=C(Nc1ccc2ccccc2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-518-142 |
0.74 |
CCCCCNC(=O)[C@@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(C)C |
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| MolPort-008-348-240 |
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Fc1ccc2ccn(CC(=O)N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1 |
|
| MolPort-002-160-250 |
0.74 |
CCOc1cc(CN2CC3CC(C2)c2cccc(=O)n2C3)ccc1OC |
|
| MolPort-002-160-223 |
0.74 |
COc1cc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc(OC)c1OC |
|
| MolPort-019-806-250 |
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Cc1ccc2cc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c(=O)[nH]c2c1 |
|
| MolPort-009-745-054 |
0.74 |
O=C(CSC1CCCC1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-517-742 |
0.74 |
CCCNC(=O)[C@@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(C)C |
|
| MolPort-002-160-219 |
0.74 |
O=c1cccc2C3CC(CN(Cc4cccc(OCc5ccccc5)c4)C3)Cn12 |
|
| MolPort-002-509-647 |
0.74 |
O=C(Nc1cccc2ccccc12)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-768-583 |
0.74 |
Cl.COC(=O)c1cccc(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1 |
|
| MolPort-039-195-311 |
0.74 |
COc1ccc(CCNC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MCULE-6726769849 |
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CCCCCCC1=C(OC(C)=O)C=C2C(C(C(C3=CC=CC=C3)=CO2)=O)=C1 |
|
| MolPort-002-518-615 |
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COc1cccc(OCC(O)CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1 |
|
| MCULE-9957786749 |
0.74 |
C1(C2=CC=CC=C2)=COC2=C(C=C(C(OC)=C2)CCCCCC)C1=O |
|
| MolPort-039-346-648 |
0.74 |
O=C(CCCc1c[nH]c2ccccc12)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MCULE-7218574716 |
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C1(C2=CC=CC=C2)=COC2=C(C=C(C(OC(C)=O)=C2)CCC)C1=O |
|
| MolPort-002-512-688 |
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O=C(CN1C[C@H]2CC(C1)c1cccc(=O)n1C2)c1c[nH]c2ccccc12 |
|
| MCULE-3648335235 |
0.74 |
C1(C2=CC=CC=C2)=COC2=C(C=C(C(OC)=C2)CCC)C1=O |
|
| MolPort-046-595-497 |
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[O-][N+](=O)c1ccc2C3CNCC(C3)Cn2c1=O |
|
| MCULE-5063279187 |
0.74 |
C1(C2=CC=C(C=C2)OC)=COC2C(=CC(=C(OCC(OC)=O)C=2)CC)C1=O |
|
| MolPort-046-597-265 |
0.74 |
COc1ccc(cc1OC)C(=O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-920 |
0.74 |
O=C(COc1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-100 |
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Clc1ccccc1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-028-855-051 |
0.74 |
O=C(CCCc1c[nH]c2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-057-715 |
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O=C(C1CCCN(C1)c1ncccn1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-346-648 |
0.74 |
O=C(CCCc1c[nH]c2ccccc12)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-044-432-108 |
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O=C(CCCCCN1Cc2ccccc2C1=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-951 |
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FC(F)(F)c1cccc(CNC(=O)CCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1 |
|
| MolPort-039-056-827 |
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COc1ccccc1CCN1CC(CC1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-343-016 |
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CCOc1ccc(NC(=O)CN2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-057-907 |
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O=C(CCCCCN1Cc2ccccc2C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-009-489 |
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CCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(N)c1 |
|
| MolPort-035-701-739 |
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CCNC(=O)c1ccc(N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(N)c1 |
|
| MolPort-039-195-008 |
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O=C(CC1(CCSCC1)n1cccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-045-946-995 |
0.74 |
O=C(CCn1cnc2ccccc12)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-027-838-572 |
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Brc1ccc2ccn(CC(=O)N3C[C@@H]4CC(C3)c3cccc(=O)n3C4)c2c1 |
|
| MolPort-044-810-022 |
0.74 |
[O-][N+](=O)c1ccc2[C@@H]3CNC[C@H](C3)Cn2c1=O |
|
| MolPort-046-768-583 |
0.74 |
Cl.COC(=O)c1cccc(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1 |
|
| MolPort-027-718-858 |
0.74 |
Cn1c2ccccc2cc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1=O |
|
| MolPort-027-838-590 |
0.74 |
Fc1ccc2ccn(CC(=O)N3C[C@@H]4CC(C3)c3cccc(=O)n3C4)c2c1 |
|
| MolPort-039-193-929 |
0.74 |
FC(F)(F)c1cccc(c1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-722-488 |
0.74 |
Oc1c(Cl)cc(Cl)cc1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-028-856-402 |
0.74 |
O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cccc2[nH]ccc12 |
|
| MolPort-042-646-419 |
0.74 |
[O-][N+](=O)c1ccc2[C@@H]3CNC[C@@H](C3)Cn2c1=O |
|
| MolPort-046-454-447 |
0.74 |
CCn1c(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)nc2ccccc12 |
|
| MolPort-039-195-311 |
0.74 |
COc1ccc(CCNC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-045-903-048 |
0.74 |
Cc1nc[nH]c1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-533-705 |
0.74 |
Cc1nc2ccccc2n1CCC(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-346-650 |
0.74 |
O=C(CCc1c[nH]c2ccccc12)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-042-644-547 |
0.74 |
CC(C)C(NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O |
|
| MolPort-039-193-990 |
0.74 |
Cc1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-045-968-449 |
0.74 |
Cc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)o1 |
|
| MolPort-002-531-027 |
0.74 |
CC(C)(C)OC(=O)NCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-811-323 |
0.74 |
Brc1cccc2n(CC(=O)N3C[C@@H]4CC(C3)c3cccc(=O)n3C4)ccc12 |
|
| MolPort-035-873-395 |
0.74 |
Clc1cccc2n(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12 |
|
| MolPort-046-068-635 |
0.74 |
Cc1cc(O)cc(=O)n1CC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-181-212 |
0.74 |
O=C(CCc1nc2ccccc2c(=O)[nH]1)NCCN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-027-718-732 |
0.74 |
Cl.COc1ccc(cc1OC)C(=O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-432-052 |
0.74 |
Clc1ccc2ccn(CC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)c2c1 |
|
| MolPort-046-424-538 |
0.74 |
Cc1cc(O)cc(=O)n1CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-424-058 |
0.74 |
Brc1cccc2n(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12 |
|
| MolPort-039-346-650 |
0.74 |
O=C(CCc1c[nH]c2ccccc12)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-044-432-051 |
0.74 |
Clc1cccc2n(CC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)ccc12 |
|
| MolPort-028-856-312 |
0.74 |
O=C(CCc1c[nH]c2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-345-696 |
0.74 |
Brc1cccc2n(CC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)ccc12 |
|
| MolPort-035-874-180 |
0.74 |
Clc1ccc2ccn(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1 |
|
| MolPort-035-873-946 |
0.74 |
COc1cccc2n(CCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12 |
|
| MolPort-044-179-658 |
0.74 |
O=C(CCCc1c[nH]c2ccccc12)NCCN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-044-179-809 |
0.74 |
O=C(NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C1(CCOCC1)c1ccccc1 |
|
| MolPort-039-345-638 |
0.74 |
Brc1ccc2ccn(CC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)c2c1 |
|
| MolPort-042-644-547 |
0.74 |
CC(C)C(NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O |
|
| MolPort-042-672-009 |
0.74 |
COc1ccc(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1OC |
|
| MolPort-035-874-098 |
0.74 |
O=C(CCN1Cc2ccccc2C1=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-046-597-498 |
0.74 |
O=C(CCN1Cc2ccccc2C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-027-838-589 |
0.74 |
Brc1cccc2n(CC(=O)N3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12 |
|
| MolPort-044-632-823 |
0.74 |
O=C(NC1CCN(CC1)c1ccccn1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-564-277 |
0.74 |
COC(=O)CCCCCNC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-021-806-349 |
0.74 |
COc1ccc(NC(=O)CCCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-039-194-028 |
0.74 |
CCCCC[C@H](O)\C=C\[C@H]1CCC(=O)[C@@H]1CCCCCCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-970 |
0.74 |
O=C(CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1c[nH]c2ccccc12 |
|
| MolPort-035-700-894 |
0.74 |
O=C(CCCn1cccn1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-347-821 |
0.74 |
C[C@H](NC(=O)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2)C(O)=O |
|
| MolPort-044-566-762 |
0.74 |
FC(F)(F)Oc1ccc(CC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-046-598-112 |
0.74 |
O=c1cccc2C3C[C@@H](CN(C3)C(=S)Nc3ccc4cnccc4c3)Cn12 |
|
| MolPort-019-825-842 |
0.74 |
COc1ccccc1OCC(O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-518-571 |
0.74 |
CC(C)(C)OC(=O)NCC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-345-696 |
0.74 |
Brc1cccc2n(CC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)ccc12 |
|
| MolPort-008-348-200 |
0.74 |
Brc1ccc2ccn(CC(=O)N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1 |
|
| MolPort-016-589-299 |
0.74 |
CC(C)C(NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2)C(O)=O |
|
| MolPort-001-743-543 |
0.74 |
O=C(C1CCCCC1)N1C[C@@H]2C[C@H](C1)c1ccc(C3CCCCC3)c(=O)n1C2 |
|
| MolPort-004-859-090 |
0.74 |
COc1ccc(NC(=O)CCCC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-005-947-068 |
0.74 |
COc1ccc(CC(=O)N2CC[C@@H](CC(O)=O)[C@@H](CCN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C2)cc1 |
|
| MolPort-021-806-349 |
0.74 |
COc1ccc(NC(=O)CCCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-007-931-530 |
0.74 |
O=C(CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)NC1CCCCC1 |
|
| MolPort-005-973-185 |
0.74 |
COc1ccc(CCNC(=O)CCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1OC |
|
| MolPort-044-632-823 |
0.74 |
O=C(NC1CCN(CC1)c1ccccn1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-564-277 |
0.74 |
COC(=O)CCCCCNC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-045-906-712 |
0.73 |
Fc1ccc(CN2CCC(CCC2=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1F |
|
| MolPort-030-042-349 |
0.73 |
Clc1nccc(n1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-044-811-318 |
0.73 |
O=C(CCn1c(cc2ccccc12)-c1ccccc1)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-345-668 |
0.73 |
O=C(CCn1c(cc2ccccc12)-c1ccccc1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-046-600-404 |
0.73 |
O=C(CCn1c(cc2ccccc12)-c1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-432-064 |
0.73 |
Cn1ccc2c(cccc12)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-044-181-005 |
0.73 |
O=C(CCc1c[nH]c2ccccc12)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-514-840 |
0.73 |
OC(=O)CSC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-032-785 |
0.73 |
O=c1cccc2C3CC(CN(C3)S(=O)(=O)C3CC3)Cn12 |
|
| MolPort-046-596-529 |
0.73 |
OC(=O)CSC(=S)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-728-787 |
0.73 |
CCNc1nc(OC)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-003-055-928 |
0.73 |
Cc1cccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)c1 |
|
| MolPort-039-193-918 |
0.73 |
Fc1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-002-722-290 |
0.73 |
CCCNc1nc(nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2)N1CCOCC1 |
|
| MolPort-002-742-781 |
0.73 |
Fc1ccc(CNC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-002-722-289 |
0.73 |
CCCNc1nc(OC)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-516-573 |
0.73 |
COc1ccc(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)c(Br)c1O |
|
| MolPort-002-509-411 |
0.73 |
Fc1ccc(NC(=S)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-009-758-196 |
0.73 |
Cl.Cc1cc(C)c(OCC(O)CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)c(C)c1 |
|
| MolPort-008-380-949 |
0.73 |
O=C(CCN1CCCCO1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-009-745-154 |
0.73 |
Fc1ccc(C(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c(F)c1 |
|
| MolPort-002-720-632 |
0.73 |
CC(C)Nc1nc(nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2)N1CCOCC1 |
|
| MolPort-008-347-232 |
0.73 |
Cn1c(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)nc2cc(N)ccc12 |
|
| MolPort-016-586-524 |
0.73 |
O=c1cccc2C3CC(CN(Cc4ccc-5c(Cc6ccccc-56)c4)C3)Cn12 |
|
| MolPort-044-180-964 |
0.73 |
O=C(CC1(CCOCC1)n1cccc1)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-016-586-254 |
0.73 |
Cc1ccsc1CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-518-119 |
0.73 |
COC(=O)CCNC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-028-856-184 |
0.73 |
O=C(Cc1c[nH]c2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-238-333 |
0.73 |
OC(=O)CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-001-905-868 |
0.73 |
O=c1cccc2C3CC(CN(Cc4ccc5OCOc5c4)C3)Cn12 |
|
| MolPort-003-055-932 |
0.73 |
Fc1ccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-000-751-917 |
0.73 |
[Cl-].Cc1cc(C)c(OCC(O)C[NH+]2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(C)c1 |
|
| MolPort-001-986-801 |
0.73 |
O=c1cccc2C3CC(CN(C3)c3nc(nc(n3)N3CCOCC3)N3CCOCC3)Cn12 |
|
| MolPort-000-717-167 |
0.73 |
COc1ccc(C[NH+]2CC3CC(C2)c2cccc(=O)n2C3)c(Br)c1[O-] |
|
| MolPort-002-519-221 |
0.73 |
OC(COc1ccc(Br)cc1)CN1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-057-235 |
0.73 |
CC(C)Cc1cc(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2n1 |
|
| MolPort-046-482-371 |
0.73 |
CC(C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1cnn(C)c1 |
|
| MolPort-003-182-347 |
0.73 |
COc1ccccc1\C=C\CN1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-720-630 |
0.73 |
COc1nc(NC(C)C)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-346-646 |
0.73 |
O=C(Cc1c[nH]c2ccccc12)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-728-900 |
0.73 |
CCNc1nc(nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2)N1CCOCC1 |
|
| MolPort-046-423-808 |
0.73 |
Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)nc2cc(N)ccc12 |
|
| MolPort-030-042-349 |
0.73 |
Clc1nccc(n1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-962 |
0.73 |
COc1ccc(NC(=O)C2(CCCCC2)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-028-856-184 |
0.73 |
O=C(Cc1c[nH]c2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-032-785 |
0.73 |
O=c1cccc2C3CC(CN(C3)S(=O)(=O)C3CC3)Cn12 |
|
| MolPort-042-602-482 |
0.73 |
Cc1c[nH]cc1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-288 |
0.73 |
O=C(CCN1C(=O)c2ccccc2C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-056-919 |
0.73 |
O=C(CCN1C(=O)c2ccccc2C1=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-044-566-760 |
0.73 |
Fc1cc(F)c(CC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1F |
|
| MolPort-046-598-092 |
0.73 |
Cc1cc(C)c(OCC(O)C[NH+]2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)c(C)c1 |
|
| MolPort-039-195-254 |
0.73 |
O=C(CC1(CCOCC1)n1cccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-057-044 |
0.73 |
CSCC[C@H](C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cccc1 |
|
| MolPort-044-180-639 |
0.73 |
COc1ccc2n(CC(=O)NCCN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc2c1 |
|
| MolPort-027-718-725 |
0.73 |
Fc1ccc2nc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)[nH]c(=O)c2c1 |
|
| MolPort-028-856-728 |
0.73 |
CC[C@@H](C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O |
|
| MolPort-044-564-263 |
0.73 |
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-597-027 |
0.73 |
COc1ccc2n(CC(=O)N3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc2c1 |
|
| MolPort-044-179-495 |
0.73 |
CSCC[C@@H](C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cccc1 |
|
| MolPort-035-873-319 |
0.73 |
O=C(CCCN1Cc2ccccc2C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-180-665 |
0.73 |
COc1ccc(CCC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1OC |
|
| MolPort-046-424-654 |
0.73 |
COc1ccc(C=O)cc1CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-035-874-174 |
0.73 |
Cn1ccc2c(cccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-038-425-338 |
0.73 |
Cc1cccc(=O)n1CCC(=O)NC(Cc1ccccn1)[C@H]1C[C@H](O)C1 |
|
| MolPort-039-346-646 |
0.73 |
O=C(Cc1c[nH]c2ccccc12)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-044-180-964 |
0.73 |
O=C(CC1(CCOCC1)n1cccc1)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-423-808 |
0.73 |
Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)nc2cc(N)ccc12 |
|
| MolPort-039-193-918 |
0.73 |
Fc1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-046-596-529 |
0.73 |
OC(=O)CSC(=S)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-482-371 |
0.73 |
CC(C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1cnn(C)c1 |
|
| MolPort-039-057-235 |
0.73 |
CC(C)Cc1cc(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2n1 |
|
| MolPort-039-056-532 |
0.73 |
O=C(CCCCCn1cnc2ccccc2c1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-724-687 |
0.73 |
Clc1ccc(cc1)N1CC(CC1=O)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-046-594-792 |
0.73 |
C\C(N1CC2CC(C1)c1cccc(=O)n1C2)=C1/C2C(CC1=O)C2(C)C |
|
| MolPort-046-168-287 |
0.73 |
O=C(CC1(CN2Cc3ccccc3C2=O)CCCCC1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-030-042-380 |
0.73 |
OC(=O)C1(CCCCC1)NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-046-065-864 |
0.73 |
O=C([C@H]1CC[C@H](Cn2cnc3ccccc3c2=O)CC1)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-564-230 |
0.73 |
C\C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)=C1/C2C(CC1=O)C2(C)C |
|
| MolPort-027-718-755 |
0.73 |
OC(=O)C1(CCCCC1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-003-055-935 |
0.73 |
Ic1ccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-016-591-499 |
0.73 |
CCC(C)C(NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2)C(O)=O |
|
| MolPort-002-728-397 |
0.73 |
COc1nc(NC2CCCCC2)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-019-825-710 |
0.73 |
OC(=O)c1ccccc1CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-511-973 |
0.73 |
COc1ccc(NC(=O)C2(CCCCC2)N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-007-953-849 |
0.73 |
O=C(CCN1C(=O)C2C3CC(C=C3)C2C1=O)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-039-193-962 |
0.73 |
COc1ccc(NC(=O)C2(CCCCC2)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-046-600-404 |
0.73 |
O=C(CCn1c(cc2ccccc12)-c1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-007-931-529 |
0.73 |
O=C(CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)NCCN1CCCCCC1 |
|
| MolPort-044-811-318 |
0.73 |
O=C(CCn1c(cc2ccccc12)-c1ccccc1)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-723-826 |
0.73 |
CCCCCCNc1nc(OC)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-046-596-404 |
0.73 |
COc1ccc(CNC(=O)CCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-045-906-712 |
0.73 |
Fc1ccc(CN2CCC(CCC2=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1F |
|
| MolPort-039-345-668 |
0.73 |
O=C(CCn1c(cc2ccccc12)-c1ccccc1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-008-348-188 |
0.73 |
O=C(CCn1c(cc2ccccc12)-c1ccccc1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-510-989 |
0.73 |
COc1ccc(CNC(=O)CCC(=O)N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-007-981-006 |
0.73 |
[O-][N+](=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)C#N |
|
| MolPort-000-793-648 |
0.73 |
[O-][N+](=O)c1ccc(N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)c(C=O)c1 |
|
| MolPort-009-759-161 |
0.73 |
Clc1nccc(n1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-194-288 |
0.73 |
O=C(CCN1C(=O)c2ccccc2C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-181-005 |
0.73 |
O=C(CCc1c[nH]c2ccccc12)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-002-512-492 |
0.73 |
CN1C(=O)N(C)C(=O)C(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2ccc3CCc4cccc2c34)C1=O |
|
| MolPort-046-597-027 |
0.73 |
COc1ccc2n(CC(=O)N3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc2c1 |
|
| MolPort-002-507-595 |
0.73 |
CC[C@H](C)[C@H](NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O |
|
| MolPort-007-931-549 |
0.73 |
O=C(CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)N1CCCC1 |
|
| MolPort-007-931-531 |
0.73 |
O=C(CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)NC1CCCC1 |
|
| MolPort-002-519-200 |
0.73 |
CC(C)C[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O |
|
| MolPort-002-510-363 |
0.73 |
COc1ccc(C=O)cc1CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-566-760 |
0.73 |
Fc1cc(F)c(CC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1F |
|
| MolPort-002-525-788 |
0.73 |
CC(C)c1ccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1 |
|
| MolPort-027-718-725 |
0.73 |
Fc1ccc2nc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)[nH]c(=O)c2c1 |
|
| MolPort-007-931-535 |
0.73 |
CCCN(CCC)CCNC(=O)CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-002-713-449 |
0.73 |
COc1nc(OC)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2 |
|
| MolPort-016-587-608 |
0.73 |
CC(C)CC(NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2)C(O)=O |
|
| MolPort-035-874-174 |
0.73 |
Cn1ccc2c(cccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-039-057-044 |
0.73 |
CSCC[C@H](C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cccc1 |
|
| MolPort-002-507-526 |
0.73 |
CC(C)C[C@H](NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O |
|
| MolPort-008-347-745 |
0.73 |
COc1ccc2n(CC(=O)N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)ccc2c1 |
|
| MolPort-000-819-900 |
0.73 |
O=C(N1CCOCC1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MolPort-044-180-639 |
0.73 |
COc1ccc2n(CC(=O)NCCN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc2c1 |
|
| MolPort-038-425-338 |
0.73 |
Cc1cccc(=O)n1CCC(=O)NC(Cc1ccccn1)[C@H]1C[C@H](O)C1 |
|
| MolPort-044-179-495 |
0.73 |
CSCC[C@@H](C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cccc1 |
|
| MolPort-044-564-230 |
0.73 |
C\C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)=C1/C2C(CC1=O)C2(C)C |
|
| MolPort-044-180-665 |
0.73 |
COc1ccc(CCC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1OC |
|
| MolPort-002-517-369 |
0.73 |
CCC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O |
|
| MolPort-044-564-263 |
0.73 |
C[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MCULE-6434560266 |
0.73 |
C1(C2=CC=C3C(OCCO3)=C2)=COC2=C(C=C(C(OC(C)C)=C2)CCC)C1=O |
|
| MolPort-035-873-319 |
0.73 |
O=C(CCCN1Cc2ccccc2C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2 |
|
| MCULE-8226162151 |
0.73 |
C1(C2C=CC=CC=2)=COC2=C(C=C(C(OCC3C=CC=CC=3)=C2)CCCCCC)C1=O |
|