SANC00856 Erythrinin C



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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
MolPort-039-194-103 0.87 OC(CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccccc1
MolPort-028-926-937 0.87 OC(=O)CN1CC2CC(C1)c1cccc(=O)n1C2
MolPort-046-554-133 0.87 Cl.NCCC(=O)N1CC2C[C@H](C1)c1cccc(=O)n1C2
MolPort-027-837-610 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-039-193-906 0.87 CCCCCC(CCC(C)=O)C(=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-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-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-039-075-546 0.87 Cl.OC(=O)CN1CC2CC(C1)c1cccc(=O)n1C2
MolPort-028-926-937 0.87 OC(=O)CN1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-084-531 0.87 Cc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-027-837-610 0.87 Cl.NCCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-075-546 0.87 Cl.OC(=O)CN1CC2CC(C1)c1cccc(=O)n1C2
MolPort-000-834-704 0.86 Cl.C[C@H](N)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-160-258 0.86 Cc1cccc(CN2CC3CC(C2)c2cccc(=O)n2C3)c1
MolPort-027-850-160 0.86 Cl.O=C(CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2ccccc2c1
MolPort-002-506-909 0.86 OC(CCl)CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-027-718-573 0.86 Cl.O=C(CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2ccccc2c1
MolPort-002-316-915 0.86 FC(F)(F)c1ccccc1CN1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-738-491 0.86 CC(NC(=O)C(C)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C1CC2CCC1C2
MolPort-019-873-192 0.86 O=C(C1CCNCC1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-507-323 0.86 O=C(C1CCNCC1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-030-042-330 0.86 CC(C)C(N)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-044-180-023 0.86 O=C(CCn1cccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-738-491 0.86 CC(NC(=O)C(C)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C1CC2CCC1C2
MolPort-004-969-354 0.86 OC(CCl)CN1CC2CC(C1)c1cccc(=O)n1C2
MolPort-000-762-510 0.86 [Cl-].CC([NH3+])C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-009-653-445 0.86 Cl.NCCCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-006-318-890 0.86 O=C(C1CCNCC1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-000-716-218 0.86 OC(CCl)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
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MolPort-027-850-160 0.86 Cl.O=C(CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2ccccc2c1
MolPort-044-180-023 0.86 O=C(CCn1cccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-030-042-330 0.86 CC(C)C(N)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
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MolPort-046-066-171 0.85 Cl.CC(C)C[C@@H](N)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
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MolPort-000-757-307 0.85 [Cl-].CC(C)CC([NH3+])C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-000-836-510 0.85 Cl.CCC(C)[C@H](N)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
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MolPort-009-759-176 0.85 Cl.CNCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
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MCULE-1751943720 0.85 C1(O)C=C2OC=C(C3C=CC(O)=CC=3)C(=O)C2=C2OC(C)(C)CCC=12
MolPort-006-315-623 0.85 CC[C@H](C)[C@H](N)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-347-820 0.85 CC(C)C[C@H](N)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
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MolPort-002-515-335 0.85 OC(CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)Cc1ccccc1
MolPort-002-512-214 0.85 COCC(O)CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-030-042-351 0.85 CNCC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
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MolPort-046-424-331 0.85 COC(=O)CCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
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MolPort-030-042-351 0.85 CNCC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-347-820 0.85 CC(C)C[C@H](N)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
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MolPort-016-615-191 0.85 Cc1ccc(nc1)C1(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)CCNCC1
MolPort-039-345-994 0.85 O=C(CC1(CCCCC1)n1cccc1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-046-065-967 0.85 O=C(CC1(CCCCC1)n1cccc1)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
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MolPort-039-193-933 0.85 O=C(CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)NCCc1ccccc1
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MolPort-046-066-171 0.85 Cl.CC(C)C[C@@H](N)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-424-331 0.85 COC(=O)CCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-554-134 0.85 Cl.CC(C)C[C@H](N)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-042-645-898 0.85 O=C(CCCn1cccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-019-909-592 0.85 Cl.CNCC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
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MolPort-009-758-207 0.85 Cl.OC(CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)Cn1ccc2ccccc12
MolPort-002-514-579 0.85 C=CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-009-758-270 0.85 Cl.CC(C)C[C@@H](N)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-028-854-684 0.85 CC(C)(C)[C@H]1CC[C@@](CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(CC1)n1cccc1
MolPort-046-622-826 0.85 O=C(C#C)N1CC2CC(C1)c1cccc(=O)n1C2
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MolPort-019-836-212 0.85 CC[C@H](C)[C@H](N)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-000-816-233 0.85 Cl.CC(C)[C@H](N)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-509-392 0.85 O=c1cccc2[C@H]3C[C@H](CN(CC4CO4)C3)Cn12
MolPort-046-554-132 0.85 Cl.O=C(C1CCNCC1)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MolPort-002-513-466 0.85 OCC#CCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-015-163-198 0.85 NC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-006-315-624 0.85 CC(C)C[C@H](N)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-000-751-823 0.85 [Cl-].OC(C[NH+]1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)Cn1ccc2ccccc12
MolPort-027-718-606 0.85 CC(C)(C)C1CCC(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(CC1)n1cccc1
MolPort-046-065-967 0.85 O=C(CC1(CCCCC1)n1cccc1)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MolPort-046-065-968 0.85 CC(C)(C)C1CCC(CC(=O)N2C[C@@H]3CC(C2)c2cccc(=O)n2C3)(CC1)n1cccc1
MolPort-027-718-685 0.85 O=C(CC1(CCCCC1)n1cccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-345-994 0.85 O=C(CC1(CCCCC1)n1cccc1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-000-827-332 0.85 Cl.CC(C)C[C@H](N)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
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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-023-307-573 0.84 CC(NC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)C12CC3CC(CC(C3)C1)C2
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-039-056-039 0.84 Cc1ccc(C)n1CCCCCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-193-940 0.84 O=C(CCc1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-194-007 0.84 ClC(Cl)(Cl)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-046-106-774 0.84 O=C(Cc1ccc2ccccc2c1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-042-672-014 0.84 O=C(CCCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)NCCc1ccccc1
MolPort-002-026-004 0.84 O=c1cccc2C3CC(CN(C3)C(=S)NC3CCCCC3)Cn12
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MolPort-002-514-796 0.84 O=c1cccc2C3C[C@@H](CN(C3)C(C#N)c3ccccc3)Cn12
MolPort-002-523-900 0.84 O=c1cccc2C3C[C@@H](CN(C3)C(=S)NC3CC4CCC3C4)Cn12
MolPort-000-854-435 0.84 CNC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-160-247 0.84 Oc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-002-513-982 0.84 ClC(Cl)(Cl)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-003-055-924 0.84 CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
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MolPort-039-193-940 0.84 O=C(CCc1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-194-007 0.84 ClC(Cl)(Cl)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-160-262 0.84 Fc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-005-310-126 0.84 NC(=N)N1CC2CC(C1)c1cccc(=O)n1C2
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MolPort-046-106-774 0.84 O=C(Cc1ccc2ccccc2c1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-514-544 0.84 CC(=C)C(=O)N1C[C@H]2CC(C1)c1cccc(=O)n1C2
MolPort-042-672-014 0.84 O=C(CCCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)NCCc1ccccc1
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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
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MolPort-015-163-729 0.84 O=Cc1ccc(cc1)N1CC2CC(C1)c1cccc(=O)n1C2
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MolPort-002-515-617 0.84 CCCCCCCCCCCCNC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
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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
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MolPort-005-910-363 0.83 CC(C)NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
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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
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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
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MolPort-035-669-002 0.83 O=NN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
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MolPort-018-611-312 0.83 O=NN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
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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
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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
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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 0.77 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
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
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
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-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
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
MolPort-002-534-224 0.76 CC(C)(C)OC(=O)NCCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-432-026 0.76 CC(C)Oc1ccc(CCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-003-182-345 0.76 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
MolPort-000-800-752 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 0.75 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 0.75 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 0.75 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 0.75 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
MolPort-046-424-656 0.75 CC12CCCC3(CO3)C1CC1C(C2)OC(=O)C1CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-056-783 0.75 CN1C(C(CC1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccccc1
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 0.75 CN1C(C(CC1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccccc1
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
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 0.75 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 0.75 Brc1cc(Br)c(NC(=O)CN2CC3CC(C2)c2cccc(=O)n2C3)c(Br)c1
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 0.75 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 0.75 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 0.75 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 0.75 O=C(C1CCC(Cn2cnnn2)CC1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-008-347-020 0.75 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
MolPort-035-873-674 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 0.75 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 0.75 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
MolPort-044-180-441 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
MolPort-002-526-825 0.75 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 0.75 O=C(CNC(=O)c1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
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 0.75 C1(O)C=C2OC=C(C3C=C4CCC(C)(C)OC4=CC=3)C(=O)C2=CC=1
MCULE-7013333859 0.75 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
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 0.74 COc1ccc(CCNC(=O)CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1OC
MolPort-002-522-504 0.74 COC(=O)CCCCCNC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-008-347-088 0.74 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 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-000-847-002 0.74 CC(C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2c(c1)[nH]c1ccc(Cl)cc21
MolPort-044-181-212 0.74 O=C(CCc1nc2ccccc2c(=O)[nH]1)NCCN1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-345-638 0.74 Brc1ccc2ccn(CC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)c2c1
MolPort-039-194-100 0.74 Clc1ccccc1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-045-968-449 0.74 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 0.74 O=C(CCCn1cccn1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-007-931-534 0.74 CCC(C)NC(=O)CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-016-589-754 0.74 CC(NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2)C(O)=O
MolPort-046-597-265 0.74 COc1ccc(cc1OC)C(=O)CN1C[C@H]2C[C@@H](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-001-742-859 0.74 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 0.74 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 0.74 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 0.74 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 0.74 CCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(N)c1
MolPort-002-511-967 0.74 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
MolPort-005-971-070 0.74 COc1ccc(NC(=O)CCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-005-911-153 0.74 COc1ccc(NC(=O)CCC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-044-432-108 0.74 O=C(CCCCCN1Cc2ccccc2C1=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-007-931-536 0.74 CC1CCC(CC1)NC(=O)CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-193-951 0.74 FC(F)(F)c1cccc(CNC(=O)CCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MolPort-005-946-292 0.74 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc4ccccc4c3)c(=O)n1C2
MolPort-001-746-601 0.74 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
MolPort-002-517-173 0.74 Clc1ccccc1C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-009-745-127 0.74 CN(C)c1cccc(c1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-193-990 0.74 Cc1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-001-743-729 0.74 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccnc3)c(=O)n1C2
MolPort-004-975-444 0.74 Cc1ccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-002-519-119 0.74 C[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O
MolPort-039-193-970 0.74 O=C(CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1c[nH]c2ccccc12
MolPort-028-855-051 0.74 O=C(CCCc1c[nH]c2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-743-267 0.74 O=c1c(ccc2[C@H]3CNC[C@H](C3)Cn12)-c1ccc2ccccc2c1
MolPort-002-507-525 0.74 C[C@H](NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O
MolPort-027-838-572 0.74 Brc1ccc2ccn(CC(=O)N3C[C@@H]4CC(C3)c3cccc(=O)n3C4)c2c1
MolPort-035-701-739 0.74 CCNC(=O)c1ccc(N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(N)c1
MolPort-002-509-479 0.74 O=C(COc1ccccc1)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-007-931-537 0.74 CC1CCCCC1NC(=O)CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-027-718-858 0.74 Cn1c2ccccc2cc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1=O
MolPort-039-195-008 0.74 O=C(CC1(CCSCC1)n1cccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-016-586-250 0.74 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
MolPort-046-595-497 0.74 [O-][N+](=O)c1ccc2C3CNCC(C3)Cn2c1=O
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-019-880-451 0.74 Fc1ccc2ccn(CC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)c2c1
MolPort-000-761-781 0.74 CN1C(=S)N(C)C(=O)C(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2c3ccccc3cc3ccccc23)C1=O
MolPort-002-517-985 0.74 CCCCNC(=O)[C@@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(C)C
MolPort-028-856-402 0.74 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cccc2[nH]ccc12
MolPort-045-946-995 0.74 O=C(CCn1cnc2ccccc12)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-002-512-806 0.74 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 0.74 Fc1ccc2ccn(CC(=O)N3C[C@@H]4CC(C3)c3cccc(=O)n3C4)c2c1
MolPort-045-903-048 0.74 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 0.74 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
MolPort-008-348-240 0.74 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 0.74 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 0.74 CCCCCCC1=C(OC(C)=O)C=C2C(C(C(C3=CC=CC=C3)=CO2)=O)=C1
MolPort-002-518-615 0.74 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 0.74 C1(C2=CC=CC=C2)=COC2=C(C=C(C(OC(C)=O)=C2)CCC)C1=O
MolPort-002-512-688 0.74 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 0.74 [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 0.74 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 0.74 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 0.74 O=C(CCCCCN1Cc2ccccc2C1=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-193-951 0.74 FC(F)(F)c1cccc(CNC(=O)CCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MolPort-039-056-827 0.74 COc1ccccc1CCN1CC(CC1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-343-016 0.74 CCOc1ccc(NC(=O)CN2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-039-057-907 0.74 O=C(CCCCCN1Cc2ccccc2C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-009-489 0.74 CCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(N)c1
MolPort-035-701-739 0.74 CCNC(=O)c1ccc(N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(N)c1
MolPort-039-195-008 0.74 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 0.74 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
MolPort-005-975-593 0.73 Clc1ccc(cc1)N1CC(CC1=O)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-3461950721 0.73 C1(C2=CC=CC=C2)=COC2=C(C=CC(OCCC)=C2C)C1=O
MolPort-039-195-254 0.73 O=C(CC1(CCOCC1)n1cccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-8605137353 0.73 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(OCC(C3C=CC=CC=3)=O)C=2)C1=O
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
MCULE-7522902201 0.73 C1(C2C=CC(=CC=2)OC)=COC2C(=CC=C(OCCOC3=CC=C4C(OC=C(C5C=CC(=CC=5)OC)C4=O)=C3C)C=2C)C1=O
MolPort-006-317-005 0.73 O=C([C@H]1CC[C@H](Cn2cnc3ccccc3c2=O)CC1)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-9387055734 0.73 C1(=O)C(C2=CC=C(C=C2)O)=COC2=CC(OC(C)C)=CC(O)=C12
MolPort-002-536-524 0.73 O=C(C1CCC(Cn2cnc3ccccc3c2=O)CC1)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-008-346-887 0.73 Clc1ccc(cc1)N1CC(CC1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-016-589-143 0.73 O=C(C1CCC(Cn2cnc3ccccc3c2=O)CC1)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-019-633-423 0.73 NC(=O)CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-512-219 0.73 C\C(N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)=C1/[C@H]2[C@@H](CC1=O)C2(C)C
MolPort-030-042-380 0.73 OC(=O)C1(CCCCC1)NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-009-200-758 0.73 CC(C)C[C@@H](NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O
MolPort-001-743-188 0.73 CC(C)(C)C(=O)Nc1ccc2[C@H]3CNC[C@H](C3)Cn2c1=O
MolPort-002-728-871 0.73 O=c1cccc2C3CC(CN(C3)c3nc(NC4CCCCC4)nc(n3)N3CCOCC3)Cn12
MolPort-039-056-532 0.73 O=C(CCCCCn1cnc2ccccc2c1=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-027-718-755 0.73 OC(=O)C1(CCCCC1)NC(=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-042-602-482 0.73 Cc1c[nH]cc1C(=O)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-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-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-002-741-200 0.73 O=c1cccc2[C@H]3C[C@@H](CN(C3)C(=S)Nc3ccc4ncccc4c3)Cn12
MolPort-046-424-654 0.73 COc1ccc(C=O)cc1CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-519-663 0.73 C[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-046-168-287 0.73 O=C(CC1(CN2Cc3ccccc3C2=O)CCCCC1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-523-791 0.72 CC(NC(=S)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2)c1ccc(F)cc1
MolPort-002-515-493 0.72 Cc1cccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MolPort-028-856-580 0.72 O=C(CC[C@@H]1NC(=O)N(CCc2ccccc2)C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-194-024 0.72 Fc1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-002-007-569 0.72 Fc1ccc(NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-016-586-262 0.72 [O-][N+](=O)c1ccccc1\C=C\CN1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-524-135 0.72 O=C(Oc1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-512-800 0.72 CN1C(=O)N(C)C(=O)C(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(Br)cc2)C1=O
MolPort-044-179-783 0.72 O=C(Cc1c[nH]c2ccccc12)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-181-232 0.72 O=C(NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cc(=O)[nH]c2ccccc12
MolPort-002-160-269 0.72 COc1cc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc(I)c1O
MolPort-002-740-875 0.72 O=c1cccc2C3CC(CN(C3)c3nc(nc(n3)N3CCSCC3)N3CCSCC3)Cn12
MolPort-035-873-645 0.72 Cn1cc(CCCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-002-512-076 0.72 COc1ccc(CCC(=O)N[C@@H](Cc2ccccc2)C(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-044-543-342 0.72 CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(Br)cc2)C1=O
MolPort-009-759-262 0.72 CC(=O)Nc1ccc(nc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-005-947-074 0.72 CN(C)c1ccc(cc1)C(=O)N1CC[C@@H](CC(O)=O)[C@@H](CCN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)C1
MolPort-044-564-008 0.72 O=C(CCCCCn1cnc2ccccc2c1=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-509-171 0.72 O=C(CCC(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)NCCSc1ccccc1
MolPort-001-742-985 0.72 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(CC4CCCCC4)C3)Cn2c1=O)C1CC1
MolPort-002-534-754 0.72 COc1cccc(c1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-194-127 0.72 COC(=O)CC(CNC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccccc1
MolPort-008-323-001 0.72 NCCS(=O)(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-065-865 0.72 COc1cccc(c1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-046-768-549 0.72 Cl.COc1ccc(OC)c(c1)C(=O)CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-544-225 0.72 Cc1[nH]c2ccc(cc2c1C)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-743-688 0.72 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccccc3C)c(=O)n1C2
MolPort-044-566-561 0.72 OC(COc1ccc(OCc2ccccc2)cc1)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-596-862 0.72 O=C(Oc1ccccc1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-046-596-438 0.72 COc1cc(CN2C[C@H]3CC(C2)c2cccc(=O)n2C3)cc(I)c1O
MolPort-002-741-881 0.72 CC(NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc(F)cc1
MolPort-002-518-158 0.72 OC(COc1ccc(OCc2ccccc2)cc1)CN1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-007-931-551 0.72 O=C(CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)NCCc1ccccc1
MolPort-003-055-968 0.72 Cc1cccc(NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c1
MolPort-042-671-740 0.72 COc1cccc2ccn(CCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c12
MolPort-001-744-078 0.72 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)C1CCCCC1
MolPort-001-742-986 0.72 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(CC4CCCCC4)C3)Cn2c1=O)C1CCCCC1
MolPort-002-514-124 0.72 CC(C)(C)c1ccc(cc1)S(=O)(=O)CCN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-009-757-736 0.72 OC(=O)c1ccc(F)cc1.Fc1ccc(cc1)C(=O)OCCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-517-380 0.72 CC(C)CNC(=O)[C@H](Cc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-510-842 0.72 COc1ccc(CC(=O)N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1Br
MolPort-046-597-430 0.72 O=C(CCn1cnc2ccccc2c1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-515-241 0.72 COC(=O)CNC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-519-500 0.72 CCc1ccc(NC(=O)CCNC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-035-873-671 0.72 CC(=O)c1cn(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-039-194-126 0.72 CCOC(=O)CNC(=S)N1C[C@H]2CC(C1)c1cccc(=O)n1C2
MolPort-035-873-575 0.72 O=C(CCn1cnc2ccccc2c1=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-518-739 0.72 CCCCNC(=O)[C@H](Cc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-180-769 0.72 C[C@@H](N1Cc2ccccc2C1=O)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-741-561 0.72 COC(=O)C(C)NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-523-005 0.72 COC(=O)CC(CNC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccccc1
MolPort-002-517-849 0.72 O=C(NC1CCCCC1)[C@H](Cc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-518-495 0.72 CCC(C)NC(=O)[C@H](Cc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-117-928 0.72 COCCCN1C(=O)CC(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(C1=O)c1ccccc1C
MolPort-002-741-879 0.72 O=c1cccc2[C@H]3C[C@@H](CN(C3)C(=S)NC3CC4CC3C=C4)Cn12
MolPort-044-180-246 0.72 O=C(CC1(Cn2cnnn2)CCCCC1)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-510-519 0.72 COc1ccccc1CNC(=O)CCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-720-444 0.72 O=c1cccc2C3CC(CN(C3)c3nc(NCCC4=CCCCC4)nc(n3)N3CCCC3)Cn12
MolPort-002-511-354 0.72 C[C@@H]1C[C@@H]2OC(=O)C(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)[C@H]2[C@H](O)[C@]2(C)[C@H](C[C@H](OC(C)=O)C12)OC(C)=O
MolPort-002-517-783 0.72 C[C@]12CCCC(=C)C1C[C@H]1[C@@H](C2)OC(=O)C1CN1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-008-346-891 0.72 COc1ccc(cc1)N1CC(CC1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-528-983 0.72 C[C@]12CCCC(=C)[C@@H]1C[C@H]1[C@@H](C2)OC(=O)C1CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-424-384 0.72 CC1CC2OC(=O)C(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2C(O)C2(C)C(CC(OC(C)=O)C12)OC(C)=O
MolPort-002-513-913 0.72 NC(=O)CC(NC(=O)c1ccccc1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-046-597-625 0.72 COc1ccc(CCN2CC(CC2=O)C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1OC
MolPort-002-518-925 0.72 CC(C)c1ccc(NC(=O)CCNC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-039-193-938 0.72 COc1ccccc1CNC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-194-125 0.72 O=c1cccc2C3C[C@H](CN(C3)C(=S)NC3CC4CC3C=C4)Cn12
MolPort-005-016-056 0.72 Fc1ccccc1C1(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)CC(=O)N(C2CCCC2)C1=O
MolPort-039-057-254 0.72 COc1ccc(CCN2CC(CC2=O)C(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1OC
MCULE-5194228805 0.72 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(OCCC3C=CC=CC=3)C=2)C1=O
MCULE-2533710480 0.72 C1(=O)C(C2C=CC(=CC=2)O)=COC2C=C(OCCCCCCCC)C=C(O)C1=2
MCULE-6301277812 0.72 C1(C2=CC=CC=C2)=COC2C(=CC=C(OCC(C3C=CC=CC=3)=O)C=2)C1=O
MCULE-2636985119 0.72 C12=C(C=C3O[C@@H](C(C)(C)O)CC3=C1OC)OC(CO)=CC2=O
MCULE-9223564419 0.72 C1(C2C=CC(=CC=2)Br)=COC2C=C(C(CCCCCC)=CC=2C1=O)OC
MCULE-2108418955 0.72 C1(=C2C(O[C@H](C(O)(C)C)C2)=CC2=C1C(=O)C=C(CO)O2)OC
MCULE-4720424442 0.72 C1(C2C=CC(=CC=2)C(C)C)=COC2C(=CC(=C(OCC(OC)=O)C=2)CC)C1=O
MCULE-8980815298 0.72 C12=CC=C(OCCCOC3=CC=C(C(=O)C)C(O)=C3CCC)C=C1OC=C(C1=CC=CC=C1)C2=O
MCULE-9493180822 0.72 C1(C2=CC=CC=C2)=COC2=C(C=C(C(OCC3C=CC=CC=3)=C2)CCC)C1=O
MCULE-9359380382 0.72 C1(C2C=CC3=C(OCCO3)C=2)=COC2=C(C=C(C(OC)=C2)CCC)C1=O
MCULE-1500087633 0.72 C1(C2C=CC(=CC=2)OC(C)C)=COC2=C(C=C(C(OC(C)=O)=C2)CC)C1=O
MCULE-9642674949 0.72 C1(C2C=CC(=CC=2)OC)=COC2=C(C=C(C(OC(C)=O)=C2)CC)C1=O
MCULE-9377347266 0.72 C1(C2C=CC(=CC=2)OC)=COC2=C(C=C(C(OC)=C2)CC)C1=O
MolPort-002-519-415 0.72 CCCNC(=O)[C@H](Cc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-874-127 0.72 COc1cccc2ccn(CCC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)c12
MolPort-003-055-934 0.72 Brc1ccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-002-532-641 0.72 CC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-519-468 0.72 CCCCCNC(=O)[C@H](Cc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-522-997 0.72 CCOC(=O)CNC(=S)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MolPort-030-042-365 0.72 COC(=O)CNC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-518-751 0.72 COc1cccc(CCNC(=O)CCCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1OC
MolPort-046-768-549 0.72 Cl.COc1ccc(OC)c(c1)C(=O)CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-564-008 0.72 O=C(CCCCCn1cnc2ccccc2c1=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-597-625 0.72 COc1ccc(CCN2CC(CC2=O)C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1OC
MolPort-035-873-575 0.72 O=C(CCn1cnc2ccccc2c1=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-194-126 0.72 CCOC(=O)CNC(=S)N1C[C@H]2CC(C1)c1cccc(=O)n1C2
MolPort-035-873-671 0.72 CC(=O)c1cn(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-035-874-127 0.72 COc1cccc2ccn(CCC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)c12
MolPort-046-597-430 0.72 O=C(CCn1cnc2ccccc2c1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-180-769 0.72 C[C@@H](N1Cc2ccccc2C1=O)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-042-671-740 0.72 COc1cccc2ccn(CCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c12
MolPort-030-042-365 0.72 COC(=O)CNC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-312-985 0.72 Cc1ccc(C(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(Cl)c1
MolPort-035-873-645 0.72 Cn1cc(CCCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-039-193-938 0.72 COc1ccccc1CNC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-117-928 0.72 COCCCN1C(=O)CC(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(C1=O)c1ccccc1C
MolPort-039-057-254 0.72 COc1ccc(CCN2CC(CC2=O)C(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1OC
MolPort-039-194-125 0.72 O=c1cccc2C3C[C@H](CN(C3)C(=S)NC3CC4CC3C=C4)Cn12
MolPort-046-596-862 0.72 O=C(Oc1ccccc1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-046-424-384 0.72 CC1CC2OC(=O)C(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2C(O)C2(C)C(CC(OC(C)=O)C12)OC(C)=O
MolPort-044-180-246 0.72 O=C(CC1(Cn2cnnn2)CCCCC1)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-179-783 0.72 O=C(Cc1c[nH]c2ccccc12)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-181-232 0.72 O=C(NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cc(=O)[nH]c2ccccc12
MolPort-002-516-223 0.72 ClC(Cl)(Cl)C(NC(=O)c1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-194-127 0.72 COC(=O)CC(CNC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccccc1
MolPort-044-543-342 0.72 CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(Br)cc2)C1=O
MolPort-028-856-580 0.72 O=C(CC[C@@H]1NC(=O)N(CCc2ccccc2)C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-596-438 0.72 COc1cc(CN2C[C@H]3CC(C2)c2cccc(=O)n2C3)cc(I)c1O
MolPort-044-544-225 0.72 Cc1[nH]c2ccc(cc2c1C)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-065-865 0.72 COc1cccc(c1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-194-024 0.72 Fc1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-044-566-561 0.72 OC(COc1ccc(OCc2ccccc2)cc1)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-312-985 0.72 Cc1ccc(C(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(Cl)c1
MolPort-003-055-940 0.72 FC(F)(F)c1ccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-004-831-599 0.72 ClC(Cl)(Cl)C(NC(=O)c1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-514-535 0.72 OC(=O)c1ccccc1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-714-522 0.72 Clc1nc(NCC=C)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-006-317-104 0.72 COc1cccc(c1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-514-597 0.72 CN1C(=S)N(C)C(=O)C(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2ccc3CCc4cccc2c34)C1=O
MolPort-002-513-247 0.72 COc1cc(CN2C[C@@H]3CC(C2)c2cccc(=O)n2C3)cc(I)c1O
MolPort-002-514-712 0.72 CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(Cl)cc2)C1=O
MolPort-044-432-063 0.71 CC(C)n1cc(CCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-039-193-914 0.71 Clc1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-039-194-187 0.71 OC(=O)C1CC=CCC1C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-030-042-358 0.71 OC(=O)C1CC=CCC1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-027-564-653 0.71 OC(=O)C1CC=CCC1C(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-343-013 0.71 CCOC(=O)c1ccc(NC(=O)CN2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-044-180-195 0.71 CC(=O)Nc1cccc2n(CC(=O)NCCN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12
MolPort-039-193-917 0.71 CC(CCc1ccco1)NC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-044-467-259 0.71 O=C(NCc1cccc2cccnc12)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-347-436 0.71 O=C(CN1Cc2ccccc2C1=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-226-996 0.71 Cc1nnc(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)s1
MolPort-045-985-690 0.71 Oc1cc(F)ccc1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-194-132 0.71 COC(=O)C(NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(C)C
MolPort-039-194-016 0.71 Cl.CC(C)(C)c1ccc(cc1)S(=O)(=O)CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-046-596-493 0.71 CC(=O)c1ccc(NC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-035-874-090 0.71 O=C(CN1Cc2ccccc2C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-028-855-406 0.71 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1c[nH]c2ccccc12
MolPort-035-873-759 0.71 CC(C)n1cc(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-035-873-713 0.71 Cn1cc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-039-046-050 0.71 CCc1nc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n[nH]1
MolPort-027-718-338 0.71 CC(=O)N1CCc2cc(ccc12)C(=O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-431-949 0.71 COc1cccc2n(CC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)ccc12
MolPort-039-194-124 0.71 CC(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccc(Cl)cc1
MolPort-028-856-048 0.71 O=C(C[C@@H]1NC(=O)N(CCc2ccccc2)C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-701-178 0.71 CC(=O)Nc1cccc2n(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12
MolPort-039-346-860 0.71 CC(=O)Nc1cccc2n(CC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)ccc12
MolPort-039-193-899 0.71 O=C(CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)NC1CCCCC1Cc1ccco1
MolPort-039-193-908 0.71 O=C(CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)NC1CCCC1Cc1ccco1
MolPort-046-598-065 0.71 CCC(C)(C)c1ccc(OCC(O)C[NH+]2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)c(c1)C(C)(C)CC
MolPort-039-346-198 0.71 O=C(N1CC2CC(C1)c1cccc(=O)n1C2)c1cc2ccccc2[nH]1
MolPort-044-432-062 0.71 Cn1cc(CCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-039-194-076 0.71 CC(=O)c1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-039-193-942 0.71 O=C(Nc1ccc(Cc2ccc(NC(=O)N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)cc2)cc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-035-873-853 0.71 CC(C)n1cc(CCCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-035-873-843 0.71 COc1cccc2n(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12
MolPort-028-856-273 0.71 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cc2ccccc2[nH]1
MolPort-035-874-298 0.71 Cn1cc(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-046-423-662 0.71 Clc1ccc(NC(=S)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-044-564-765 0.71 COc1ccccc1OCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-027-848-038 0.71 Oc1nc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)nc2ccccc12
MolPort-046-454-446 0.71 O=c1cccc2[C@@H]3C[C@@H](CN(Cc4ccc(cc4)-n4cncn4)C3)Cn12
MolPort-046-597-950 0.71 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H]([C@@H]3[C@@H](Cc2c1)C(=O)NCCCc1ccccc1)c1cccc(=O)n1C4
MolPort-001-743-549 0.71 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(C3CCCCC3)c(=O)n1C2
MolPort-044-564-765 0.71 COc1ccccc1OCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-431-949 0.71 COc1cccc2n(CC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)ccc12
MolPort-005-309-833 0.71 Cc1ccc(cc1)C(=O)NC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-003-055-945 0.71 Cc1cccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)c1C
MolPort-005-909-747 0.71 O=c1cccc2[C@H]3C[C@@H](CN(C3)C(=S)Nc3cccnc3)Cn12
MolPort-000-747-561 0.71 [Cl-].CCC(C)(C)c1ccc(OCC(O)C[NH+]2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)c(c1)C(C)(C)CC
MolPort-002-514-368 0.71 CC(C)CC(NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-520-004 0.71 Fc1ccccc1NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-520-708 0.71 CCC(C)[C@H](NC(=O)OC(C)(C)C)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-873-713 0.71 Cn1cc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-003-055-970 0.71 Clc1ccc(NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-000-724-031 0.71 [Cl-].COc1cc(C[NH+]2C[C@H]3CC(C2)c2cccc(=O)n2C3)cc(Br)c1O
MolPort-001-743-547 0.71 O=C(NC1CCCCC1)N1C[C@@H]2C[C@H](C1)c1ccc(C3CCCCC3)c(=O)n1C2
MolPort-044-180-195 0.71 CC(=O)Nc1cccc2n(CC(=O)NCCN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12
MolPort-039-343-013 0.71 CCOC(=O)c1ccc(NC(=O)CN2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-002-518-689 0.71 Fc1ccc(NC(=O)CCNC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-002-722-919 0.71 CCCCCCNc1nc(OCC)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-193-917 0.71 CC(CCc1ccco1)NC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-030-042-358 0.71 OC(=O)C1CC=CCC1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-194-187 0.71 OC(=O)C1CC=CCC1C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-007-923-074 0.71 Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccncc1
MolPort-009-759-264 0.71 CC(C)CC(=O)Nc1ccc(nc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-027-564-653 0.71 OC(=O)C1CC=CCC1C(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-193-914 0.71 Clc1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-007-931-553 0.71 CC(CCc1ccccc1)NC(=O)CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-226-996 0.71 Cc1nnc(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)s1
MolPort-028-855-406 0.71 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1c[nH]c2ccccc12
MolPort-002-515-005 0.71 Cc1[nH]c2cc(C)ccc2c1C(=O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-347-436 0.71 O=C(CN1Cc2ccccc2C1=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-046-597-950 0.71 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H]([C@@H]3[C@@H](Cc2c1)C(=O)NCCCc1ccccc1)c1cccc(=O)n1C4
MolPort-002-514-033 0.71 COc1ccc(CCNC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1OC
MolPort-045-985-690 0.71 Oc1cc(F)ccc1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-044-432-063 0.71 CC(C)n1cc(CCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-035-874-090 0.71 O=C(CN1Cc2ccccc2C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-194-132 0.71 COC(=O)C(NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(C)C
MolPort-002-728-790 0.71 Clc1ccc(Nc2nc(nc(n2)N2CC3CC(C2)c2cccc(=O)n2C3)N2CCCCC2)cc1
MolPort-002-160-267 0.71 COc1cc(Br)c(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1OC
MolPort-035-873-759 0.71 CC(C)n1cc(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-009-757-853 0.71 Cl.COc1cc(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc(Br)c1O
MolPort-046-596-493 0.71 CC(=O)c1ccc(NC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-002-515-777 0.71 CCC(C)C(NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-003-055-931 0.71 Fc1cccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)c1
MolPort-001-744-918 0.71 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccnc3)c(=O)n1C2
MolPort-009-745-156 0.71 O=C(N1CC2CC(C1)c1cccc(=O)n1C2)c1c[nH]c2ccccc12
MolPort-002-523-572 0.71 COC(=O)C(NC(=S)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2)C(C)C
MolPort-001-744-910 0.71 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc4ccccc4c3)c(=O)n1C2
MolPort-001-743-641 0.71 O=c1c(ccc2[C@@H]3C[C@@H](CN(Cc4ccccc4)C3)Cn12)-c1ccc2ccccc2c1
MolPort-044-467-259 0.71 O=C(NCc1cccc2cccnc12)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-515-962 0.71 CC(=O)c1ccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-001-743-659 0.71 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(Cl)cc3)c(=O)n1C2
MolPort-009-758-202 0.71 Cl.CCC(C)(C)c1ccc(OCC(O)CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(c1)C(C)(C)CC
MolPort-000-764-035 0.71 O=C(Nc1ccc(Cc2ccc(NC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)cc2)cc1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-194-076 0.71 CC(=O)c1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-039-194-124 0.71 CC(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccc(Cl)cc1
MolPort-046-423-662 0.71 Clc1ccc(NC(=S)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-006-316-351 0.71 OC(=O)[C@@H](Cc1ccccc1)NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-009-745-059 0.71 Cc1ccccc1OCC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-005-970-155 0.71 OC(=O)C(Cc1ccccc1)NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-004-969-684 0.71 Nc1nnc(s1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-035-873-853 0.71 CC(C)n1cc(CCCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-002-524-362 0.71 CCc1ccccc1NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-526-398 0.71 Brc1ccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-002-516-419 0.71 ClC(Cl)(Cl)C(NC(=O)c1cccc2ccccc12)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-016-586-523 0.71 O=c1cccc2C3CC(CN(Cc4ccc5OCCOc5c4)C3)Cn12
MolPort-005-909-848 0.71 O=c1cccc2[C@H]3C[C@@H](CN(C3)C(=S)Nc3cccc4ncccc34)Cn12
MolPort-002-516-718 0.71 CC(=O)c1ccc(NC(=S)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-039-046-050 0.71 CCc1nc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n[nH]1
MolPort-003-182-343 0.71 COc1cc(OC)c(OC)cc1CN1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-741-202 0.71 CC(NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc(Cl)cc1
MolPort-004-831-613 0.71 CC(=O)NC(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-039-194-016 0.71 Cl.CC(C)(C)c1ccc(cc1)S(=O)(=O)CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-193-908 0.71 O=C(CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)NC1CCCC1Cc1ccco1
MolPort-039-193-899 0.71 O=C(CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)NC1CCCCC1Cc1ccco1
MolPort-002-508-361 0.71 O=C(CCC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)NC1CCCCC1Cc1ccco1
MolPort-002-508-797 0.71 O=C(CCC(=O)N1C[C@H]2CC(C1)c1cccc(=O)n1C2)NC1CCCC1Cc1ccco1
MolPort-005-015-225 0.71 CN1C(=O)CC(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(C1=O)c1ccccc1Cl
MolPort-027-718-338 0.71 CC(=O)N1CCc2cc(ccc12)C(=O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-028-856-273 0.71 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cc2ccccc2[nH]1
MolPort-002-516-046 0.71 CC(=O)NC(NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-035-701-178 0.71 CC(=O)Nc1cccc2n(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12
MolPort-002-511-945 0.71 COc1cc(CC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc(OC)c1OC
MolPort-002-512-967 0.71 COc1ccccc1OCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-346-860 0.71 CC(=O)Nc1cccc2n(CC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)ccc12
MolPort-002-512-245 0.71 COP(=O)(OC)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-035-874-298 0.71 Cn1cc(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-002-160-261 0.71 COc1cc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc(Br)c1O
MCULE-8301150162 0.71 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC(=C(OC(=O)C(C)(C)C)C=2)CCCCCC)C1=O
MolPort-003-757-744 0.71 OC(=O)[C@H](Cc1ccccc1)NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-9073692476 0.71 O1[C@@H](C(C)(C)O)CC2=CC3C=CC(=O)OC=3C=C12
MolPort-002-512-165 0.71 O=C(CCc1ccco1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-1893201582 0.71 O1[C@@H](C(C)(C)O)CC2=CC3C=CC(=O)OC=3C=C12
MolPort-027-848-038 0.71 Oc1nc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)nc2ccccc12
MCULE-6315803903 0.71 C1(C2=CC=C(C=C2)OC)=COC2=C(C=C(C(OCC3C=CC=CC=3)=C2)CC)C1=O
MolPort-002-507-257 0.71 OC(=O)[C@H](Cc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-4926964615 0.71 O1[C@H](C(C)(C)O)CC2=CC3C=CC(=O)OC=3C=C12
MolPort-046-598-065 0.71 CCC(C)(C)c1ccc(OCC(O)C[NH+]2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)c(c1)C(C)(C)CC
MCULE-3509624985 0.71 O1[C@H](C(C)(C)O)CC2=CC3C=CC(=O)OC=3C=C12
MolPort-009-745-149 0.71 O=C(Cc1cccs1)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-5646688269 0.71 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OC(CC)=O)C=2)CCC)C1=O
MolPort-004-974-423 0.71 Clc1ccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MCULE-1764679215 0.71 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OCC)C=2)CC)C1=O
MolPort-035-873-843 0.71 COc1cccc2n(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12
MCULE-9678709590 0.71 C1(C2C=CC=CC=2)=COC2=C(C=C(C(O)=C2)CCCC)C1=O
MolPort-002-724-762 0.71 CC1CCN(CC1)c1nc(NCCN2CCOCC2)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-8865094879 0.71 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(O)C=2)CCC)C1=O
MolPort-002-511-012 0.71 O=C(Nc1ccc(Cc2ccc(NC(=O)N3CC4C[C@H](C3)c3cccc(=O)n3C4)cc2)cc1)N1CC2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-1472732346 0.71 C1(C2=CC=CC=C2)=COC2=C(C=C(C(OC)=C2)CC)C1=O
MolPort-039-193-942 0.71 O=C(Nc1ccc(Cc2ccc(NC(=O)N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)cc2)cc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-9225093391 0.71 C1(C2C=CC=CC=2)=COC2C(=CC=C(OCC(=O)C3C=CC(=CC=3)OC)C=2)C1=O
MolPort-039-346-198 0.71 O=C(N1CC2CC(C1)c1cccc(=O)n1C2)c1cc2ccccc2[nH]1
MCULE-2110686485 0.71 C1(C2=CC=C3C(OCCO3)=C2)=COC2=C(C=C(C(OC(C)C)=C2)CC)C1=O
MolPort-046-454-446 0.71 O=c1cccc2[C@@H]3C[C@@H](CN(Cc4ccc(cc4)-n4cncn4)C3)Cn12
MCULE-3188434807 0.71 O1C(C(C)(C)O)CC2=CC3C=CC(=O)OC=3C=C12
MolPort-044-432-062 0.71 Cn1cc(CCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-007-980-962 0.71 CCOc1ccc(C=O)cc1CN1CC2CC(C1)c1cccc(=O)n1C2
MolPort-001-743-754 0.71 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cncnc3)c(=O)n1C2
MolPort-002-518-030 0.71 O=C(NC1CCCC1)[C@H](Cc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-028-856-048 0.71 O=C(C[C@@H]1NC(=O)N(CCc2ccccc2)C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-744-068 0.70 O=C(N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)C1CCCCC1)c1ccccc1
MolPort-004-831-625 0.70 Cc1ccc(cc1)C(=O)NC(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-027-718-682 0.70 Clc1ccc2c(c1)nc(CN1C[C@H]3C[C@@H](C1)c1cccc(=O)n1C3)[nH]c2=O
MolPort-016-588-668 0.70 COC(=O)C(C)NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-513-201 0.70 Brc1ccc(cc1)C(=O)\C=C\N1C[C@H]2CC(C1)c1cccc(=O)n1C2
MolPort-002-514-964 0.70 CC(C)(C)c1ccc(cc1)C(=O)NC(=S)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MolPort-039-194-089 0.70 FC(F)(F)c1cccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MolPort-035-873-803 0.70 COCCn1ccc2ccc(cc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-004-831-601 0.70 CC(C)C(=O)NC(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-002-511-464 0.70 CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2ccc(cc2)[N+]([O-])=O)C1=O
MolPort-002-513-865 0.70 CCOC(=O)CNC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-004-831-603 0.70 CCC(=O)NC(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-035-873-258 0.70 C[C@H](N1Cc2ccccc2C1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-000-772-460 0.70 [Cl-].[NH3+][C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-516-110 0.70 Cc1ccc(cc1)C(=O)NC(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-046-626-452 0.70 CC(=O)N1CC2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-009-758-206 0.70 Cl.N[C@@H](Cc1c[nH]c2ccccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-009-745-159 0.70 O=C(CN1C(=O)c2ccccc2C1=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-516-320 0.70 CC(C)C(=O)NC(NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-002-728-789 0.70 Clc1ccc(Nc2nc(nc(n2)N2CC3CC(C2)c2cccc(=O)n2C3)N2CCCC2)cc1
MolPort-002-728-788 0.70 CCNc1nc(OCC)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-046-120-874 0.70 Cc1conc1CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-720-631 0.70 CCOc1nc(NC(C)C)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-003-055-930 0.70 Clc1cccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)c1
MolPort-046-597-127 0.70 O=C(Cn1c(cc2ccccc12)-c1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-513-346 0.70 COc1ccc(CC2(CN3CC4C[C@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C3CCCCC3)C2=O)cc1
MolPort-005-308-648 0.70 [O-][N+](=O)c1ccc(NC(=O)CN2CC3CC(C2)c2cccc(=O)n2C3)c(Br)c1
MolPort-035-700-523 0.70 Cc1cc(C)nc(NCCCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n1
MolPort-035-873-778 0.70 CC(C)C(N1Cc2ccccc2C1=O)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-044-179-806 0.70 CC[C@H](C)[C@H](N1Cc2ccccc2C1=O)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-516-140 0.70 Clc1cccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MolPort-002-516-126 0.70 CC1(C)C(C=C(Cl)Cl)C1C(=O)NC(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-045-989-341 0.70 CC1(C)CC1Cn1nnnc1N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-027-838-276 0.70 CCCC(=O)NC(NC(=S)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-039-194-021 0.70 COc1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-000-844-546 0.70 OC(COc1ccccc1CC=C)CN1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-194-049 0.70 Cc1cccc(c1)C(=O)NC(=S)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-512-735 0.70 CC(N1C(=O)c2ccccc2C1=O)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-516-071 0.70 CCCC(=O)NC(NC(=S)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-002-513-933 0.70 COc1ccc(CNC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-039-347-419 0.70 CC(C)n1cc(cn1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-514-265 0.70 COc1ccc(NC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-039-194-006 0.70 COc1ccc(CNC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-044-565-922 0.70 CC(N1C(=O)c2ccccc2C1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-514-949 0.70 CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3CC(C2)c2cccc(=O)n2C3)(Cc2c(Cl)cccc2Cl)C1=O
MolPort-002-515-388 0.70 Cc1cccc(c1)C(=O)NC(=S)N1C[C@H]2CC(C1)c1cccc(=O)n1C2
MolPort-046-597-874 0.70 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H]([C@@H]3[C@@H](Cc2c1)C(=O)NCCc1ccccn1)c1cccc(=O)n1C4
MolPort-006-827-665 0.70 Brc1ccc(NC(=O)CN2CC3CC(C2)c2cccc(=O)n2C3)nc1
MolPort-005-970-705 0.70 O=C(CCC(=O)N1CC2CC(C1)c1cccc(=O)n1C2)NCc1ccco1
MolPort-007-931-555 0.70 CCCCN(CCCNC(=O)CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)c1ccccc1
MolPort-005-947-073 0.70 COc1ccc(cc1)C(=O)N1CC[C@@H](CC(O)=O)[C@@H](CCN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)C1
MolPort-005-910-946 0.70 O=C(CCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)NCc1ccco1
MolPort-002-735-910 0.70 Clc1ccccc1NC(=O)N1CC2C[C@H](C1)c1cccc(=O)n1C2
MolPort-003-055-929 0.70 Clc1ccccc1NC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-518-496 0.70 Cc1ccc(NC(=O)CCNC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(C)c1
MolPort-035-873-443 0.70 Cn1c(cc2ccccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-005-310-068 0.70 [O-][N+](=O)c1cc(I)c(NC(=O)CN2CC3CC(C2)c2cccc(=O)n2C3)c(I)c1
MolPort-002-519-254 0.70 Cc1cc(C)cc(NC(=O)CCNC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MolPort-005-973-784 0.70 O=C(CCCC(=O)N1CC2CC(C1)c1cccc(=O)n1C2)NCc1ccco1
MolPort-001-743-546 0.70 O=C(N1C[C@@H]2C[C@H](C1)c1ccc(C3CCCCC3)c(=O)n1C2)c1ccncc1
MolPort-009-745-062 0.70 Fc1ccc(SCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-044-432-050 0.70 Cn1c(cc2ccccc12)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-004-975-498 0.70 Fc1cc(F)cc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)c1
MolPort-044-466-170 0.70 CC(C)Cn1ccnc1CNC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-004-831-614 0.70 CC1(C)C(C=C(Cl)Cl)C1C(=O)NC(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-009-745-129 0.70 O=C(Cn1cnc2ccccc12)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-008-323-900 0.70 Clc1ccccc1NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-160-286 0.70 COc1cc(Br)cc(CN2CC3CC(C2)c2cccc(=O)n2C3)c1O
MolPort-003-055-937 0.70 COc1ccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-009-745-147 0.70 Fc1ccccc1OCC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-045-903-034 0.70 COc1cc(OC)c(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1Br
MolPort-045-903-032 0.70 Brc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)o1
MolPort-044-179-593 0.70 CCC(C)C(N1Cc2ccccc2C1=O)C(=O)NCCN1CC2CC(C1)c1cccc(=O)n1C2
MolPort-044-179-479 0.70 O=C(CCn1c(=O)[nH]c2ccccc2c1=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-042-671-745 0.70 CC(C)[C@H](N1Cc2ccccc2C1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-003-055-969 0.70 Clc1cccc(NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c1
MolPort-042-645-377 0.70 Oc1nc(CCCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)nc2ccccc12
MolPort-003-055-944 0.70 CCc1cccc(CC)c1NC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-003-055-941 0.70 [O-][N+](=O)c1ccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-042-600-623 0.70 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccc(OCC#C)cc1
MolPort-039-193-939 0.70 COc1cc(CNC(=O)CCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc(OC)c1
MolPort-046-163-470 0.70 Nc1ccc2N3C[C@@H]4C[C@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(O)=O
MolPort-046-163-470 0.70 Nc1ccc2N3C[C@@H]4C[C@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(O)=O
MolPort-039-194-021 0.70 COc1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-039-194-261 0.70 O=C(CN1C(=O)c2ccccc2C1=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-027-718-682 0.70 Clc1ccc2c(c1)nc(CN1C[C@H]3C[C@@H](C1)c1cccc(=O)n1C3)[nH]c2=O
MolPort-035-873-803 0.70 COCCn1ccc2ccc(cc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-120-874 0.70 Cc1conc1CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-194-000 0.70 CCOC(=O)CNC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-035-873-258 0.70 C[C@H](N1Cc2ccccc2C1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-194-089 0.70 FC(F)(F)c1cccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MolPort-046-626-452 0.70 CC(=O)N1CC2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-046-596-068 0.70 Nc1ccc2N3CC4CC(Cn5c4cccc5=O)C3C(Cc2c1)C(O)=O
MolPort-042-646-662 0.70 Nc1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(O)=O
MolPort-044-179-479 0.70 O=C(CCn1c(=O)[nH]c2ccccc2c1=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-597-012 0.70 O=C(CCCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)NCc1ccco1
MolPort-046-597-127 0.70 O=C(Cn1c(cc2ccccc12)-c1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-057-288 0.70 COc1ccccc1CN1CC(CC1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-193-988 0.70 COc1ccc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C3CCCCC3)C2=O)cc1
MolPort-027-838-276 0.70 CCCC(=O)NC(NC(=S)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-045-903-032 0.70 Brc1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)o1
MolPort-044-466-170 0.70 CC(C)Cn1ccnc1CNC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-042-645-377 0.70 Oc1nc(CCCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)nc2ccccc12
MolPort-039-194-049 0.70 Cc1cccc(c1)C(=O)NC(=S)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-042-600-623 0.70 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccc(OCC#C)cc1
MolPort-044-179-593 0.70 CCC(C)C(N1Cc2ccccc2C1=O)C(=O)NCCN1CC2CC(C1)c1cccc(=O)n1C2
MolPort-045-903-034 0.70 COc1cc(OC)c(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1Br
MolPort-039-193-950 0.70 CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(cc2)[N+]([O-])=O)C1=O
MolPort-035-873-686 0.70 CC(C)n1cc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-039-193-939 0.70 COc1cc(CNC(=O)CCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc(OC)c1
MolPort-044-565-922 0.70 CC(N1C(=O)c2ccccc2C1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-042-417 0.70 O=c1cccc2[C@H]3C[C@H](CN(Cc4cncn4C4CCCCC4)C3)Cn12
MolPort-046-597-874 0.70 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H]([C@@H]3[C@@H](Cc2c1)C(=O)NCCc1ccccn1)c1cccc(=O)n1C4
MolPort-039-347-419 0.70 CC(C)n1cc(cn1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-873-443 0.70 Cn1c(cc2ccccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-179-806 0.70 CC[C@H](C)[C@H](N1Cc2ccccc2C1=O)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-598-096 0.70 OC(C[NH+]1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)Cn1c2CCCCc2c2ccccc12
MolPort-039-194-006 0.70 COc1ccc(CNC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-042-671-745 0.70 CC(C)[C@H](N1Cc2ccccc2C1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-873-778 0.70 CC(C)C(N1Cc2ccccc2C1=O)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-045-989-341 0.70 CC1(C)CC1Cn1nnnc1N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-035-700-523 0.70 Cc1cc(C)nc(NCCCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n1
MolPort-044-432-050 0.70 Cn1c(cc2ccccc12)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-7069465243 0.70 C1(C2C=CC3=C(OCCO3)C=2)=COC2=C(C=C(C(OC(C)=O)=C2)CCC)C1=O
MCULE-4977318522 0.70 C1(C2=CC=CC=C2)=COC2=C(C=CC(OCC)=C2C)C1=O
MCULE-8495680852 0.70 C12C(O)=CC3=C(C(C4C=CC(=CC=4)OCCC4C=CC(=CC=4)OC)CC(=O)O3)C=1OC=C(C1=CC=CC=C1)C2=O
MCULE-8568126145 0.70 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=CC=3OCCC3C=CC4=C(CCO4)C=3)C=1OC=C(C1=CC=CC=C1)C2=O
MCULE-5454148782 0.70 C1(=O)C(C2C=CC(=CC=2)OCC)=COC2C=C(OCC)C=C(OCC)C1=2
MolPort-039-042-417 0.70 O=c1cccc2[C@H]3C[C@H](CN(Cc4cncn4C4CCCCC4)C3)Cn12
MCULE-8917006763 0.70 COC1=CC=C(C2C(=O)C3=C(C=C(C=C3)OCC3CC3)OC=2)C=C1
MolPort-015-137-380 0.70 OC(=O)C1C2CC(C=C2)C1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-6312808279 0.70 C1(C2=CC=C(C=C2)Cl)=COC2C(=CC(=C(OC(C(CC)CC)=O)C=2)CCCCCC)C1=O
MolPort-046-598-096 0.70 OC(C[NH+]1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)Cn1c2CCCCc2c2ccccc12
MCULE-8927002744 0.70 C1(C2=CC=C(C=C2)Cl)=COC2C(=CC=C(OCCCC3C=CC=CC=3)C=2)C1=O
MolPort-002-728-398 0.70 CCOc1nc(NC2CCCCC2)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-7070671239 0.70 C1(C2C=CC3=C(OCCO3)C=2)=COC2=C(C=C(C(OCC(OC)=O)=C2)CCC)C1=O
MolPort-005-947-066 0.70 OC(=O)C[C@@H]1CCN(C[C@@H]1CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(=O)COc1ccccc1
MCULE-2950574814 0.70 C1(C2C=CC3=C(OCCO3)C=2)=COC2=C(C=C(C(OC(C)C(OC)=O)=C2)CCC)C1=O
MolPort-002-510-735 0.70 COc1cc(CNC(=O)CCC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(OC)c1
MCULE-7082307905 0.70 C1(C2=CC=C(C=C2)C(C)C)=COC2C(=CC(=C(OC)C=2)CC)C1=O
MolPort-005-012-170 0.70 COc1ccc(F)c(CC2(CCC(=O)N3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)CCC(=O)N2)c1
MCULE-4662967198 0.70 C1(C2=CC=CC=C2Cl)=COC2C(=CC=C(OCCC3=CC=CC=C3)C=2)C1=O
MolPort-001-743-539 0.70 O=C(N1C[C@@H]2C[C@H](C1)c1ccc(C3CCCCC3)c(=O)n1C2)c1ccccc1
MCULE-9359456797 0.70 C12C(O)=CC3=C(C(C4=CC=C(C=C4)OCCC4=CC=C(C=C4)OC)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-002-517-554 0.70 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(NC(C)=O)cc1
MCULE-2056276936 0.70 C12OC=C(C(=O)C1=CC=C(OC)C=2C(C1=CC=C(C=C1)OCCC1C=CC(=CC=1)OC)CC(OC)=O)C1=CC=C(C=C1)OC
MolPort-002-509-825 0.70 COc1ccc(CNC(=O)CCC(=O)N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1OC
MCULE-9294577888 0.70 C1(=O)C2=CC(CC)=C(C=C2OC(C)=C1C1C=CC(=CC=1)OC)OCC
MolPort-002-516-407 0.70 CCC(=O)NC(NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MCULE-5413877543 0.70 C12C(O)=CC3=C(C(C(C)C)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-002-524-351 0.70 Fc1ccccc1NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-5640212438 0.70 C1(C2=CC=C(C=C2)OC)=COC2=C(C=C(C(O)=C2)CC)C1=O
MolPort-003-055-939 0.70 FC(F)(F)c1cccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)c1
MolPort-002-524-185 0.70 COC(=O)[C@H](C)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-744-276 0.70 O=c1ccc(-c2cccnc2)c2[C@@H]3C[C@@H](CN(CCCc4ccccc4)C3)Cn12
MolPort-003-055-943 0.70 CCc1cccc(C)c1NC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-509-121 0.70 COc1ccc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)cc1
MolPort-035-873-686 0.70 CC(C)n1cc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-003-055-946 0.70 Cc1ccc(C)c(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)c1
MolPort-039-193-950 0.70 CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(cc2)[N+]([O-])=O)C1=O
MolPort-039-194-261 0.70 O=C(CN1C(=O)c2ccccc2C1=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-517-003 0.70 FC(F)(F)c1cccc(NC(=S)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MolPort-019-813-286 0.70 COc1ccc2cc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c(=O)[nH]c2c1
MolPort-019-879-932 0.70 Fc1ccccc1NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-512-821 0.70 C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)C(CN4C[C@@H]5C[C@@H](C4)c4cccc(=O)n4C5)[C@H]3C3OC123
MolPort-042-646-662 0.70 Nc1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(O)=O
MolPort-046-596-068 0.70 Nc1ccc2N3CC4CC(Cn5c4cccc5=O)C3C(Cc2c1)C(O)=O
MolPort-001-746-589 0.70 O=c1cccc2[C@@H]3C[C@@H](CN(C[C@H]4C[N@@]5CC[C@H]4C[C@@H]5CNS(=O)(=O)c4ccccc4)C3)Cn12
MolPort-016-596-403 0.70 C=CCNc1ccccc1C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-057-288 0.70 COc1ccccc1CN1CC(CC1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-005-911-041 0.70 O=C(CCCC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)NCc1ccco1
MolPort-001-746-596 0.70 CC(=O)c1ccc(NC(=O)NC[C@H]2C[C@@H]3CC[N@]2C[C@@H]3CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-046-597-012 0.70 O=C(CCCC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)NCc1ccco1
MolPort-008-347-031 0.70 O=C(Cn1c(cc2ccccc12)-c1ccccc1)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MolPort-001-745-148 0.70 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(NC(=O)C(C)(C)C)ccc(=O)n1C2
MolPort-039-194-000 0.70 CCOC(=O)CNC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-003-055-933 0.70 Brc1cccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)c1
MolPort-039-193-988 0.70 COc1ccc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C3CCCCC3)C2=O)cc1
MolPort-003-186-890 0.70 CCCNc1nc(OCC)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-035-701-315 0.69 Cc1cc(C)n(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n1
MolPort-044-431-903 0.69 Cc1cc(C)n(CCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)n1
MolPort-039-193-966 0.69 CC(C)CC(N1C(=O)c2ccccc2C1=O)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-035-873-310 0.69 O=C(CCc1ccc2OCCc2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-193-986 0.69 COc1ccc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=S)N(C)C2=O)c2ccccc12
MolPort-044-565-740 0.69 Oc1nc(CCC(=O)NCCN2CC3CC(C2)c2cccc(=O)n2C3)nc2ccccc12
MolPort-035-873-586 0.69 O=C(Cc1ccc2OCCc2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-873-660 0.69 CC(=O)c1cn(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-029-886-032 0.69 Fc1cccc(CCN2C(=O)N[C@@H](CCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)c1
MolPort-039-056-896 0.69 CC(C)n1ccc2c(OCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cccc12
MolPort-039-058-034 0.69 Cn1ccc2c(OCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cccc12
MolPort-035-873-930 0.69 O=C(Cc1n[nH]c(=O)c2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-873-689 0.69 Cc1cc(C)nc(n1)N1CCCC(C1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-768-578 0.69 O=C(CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)NC1CCS(=O)(=O)C1
MolPort-046-596-065 0.69 NNC(=O)C(Cc1ccccc1)NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-055-826 0.69 CC(C)CCn1ccc2c(OCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cccc12
MolPort-027-564-811 0.69 COC(=O)[C@H](CC(C)C)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-180-029 0.69 O=C(Cc1ccc2OCCc2c1)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-543-346 0.69 Cc1ccc2oc(=O)cc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-042-672-010 0.69 O=C(C(Cc1ccccc1)N1Cc2ccccc2C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-030-042-366 0.69 COC(=O)C(CC(C)C)NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-193-980 0.69 COc1ccc(cc1)C(=O)\C=C\N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-194-243 0.69 CC1(C)OC(=O)C(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2cccc3ccccc23)C(=O)O1
MolPort-044-464-859 0.69 CN(C)c1ncc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cn1
MolPort-044-431-997 0.69 CC(C)n1ccc2c(OCC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)cccc12
MolPort-044-634-909 0.69 Fc1cc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(F)c1F
MolPort-027-564-813 0.69 CC[C@@H](C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)OC
MolPort-035-874-142 0.69 Cc1nc2ccc(cc2nc1C)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-056-421 0.69 CC1(C)CCc2cc(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc2O1
MolPort-039-056-809 0.69 CC(C)Cn1ccc2c(OCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cccc12
MolPort-039-193-947 0.69 Clc1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1Cl
MolPort-027-564-335 0.69 Cc1cc(=O)c(O)c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n1C
MolPort-044-431-995 0.69 Cn1ccc2c(OCC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)cccc12
MolPort-044-431-996 0.69 CC(C)CCn1ccc2c(OCC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)cccc12
MolPort-044-430-822 0.69 O=C([C@H](Cc1ccccc1)N1Cc2ccccc2C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-194-046 0.69 Brc1ccc(cc1)C(=O)NC(=S)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-027-718-550 0.69 COc1ccc2n(C)c(=O)c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc2c1
MolPort-046-598-079 0.69 Cc1cc(Br)c(OCC(O)C[NH+]2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(Br)c1
MolPort-039-194-157 0.69 CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-027-718-714 0.69 Cc1c(C(=O)CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2n1C
MolPort-044-466-161 0.69 CC1(C)COCCN1CCNC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-035-701-565 0.69 CC(C)[C@H](NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCCn1ccc2ccccc12
MolPort-035-873-598 0.69 CC(C)C[C@H](N1Cc2ccccc2C1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-524-069 0.69 Oc1ccc(Cl)c(c1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-000-715-503 0.69 [Cl-].COc1cc(OC)c(C[NH+]2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1Br
MolPort-030-042-366 0.69 COC(=O)C(CC(C)C)NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-009-757-855 0.69 Cl.COc1cc(OC)c(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1Br
MolPort-009-653-466 0.69 OC(=O)C(O)=O.NCCS(=O)(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-003-757-746 0.69 COC(=O)[C@@H](NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(C)C
MolPort-035-873-598 0.69 CC(C)C[C@H](N1Cc2ccccc2C1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-520-824 0.69 Clc1cc(Cl)cc(NC(=S)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MolPort-008-363-565 0.69 CCC(=O)c1ccc(OCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-044-543-347 0.69 Cc1ccc2c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc(=O)oc2c1
MolPort-046-597-424 0.69 CC[C@H](C)[C@@H](N1Cc2ccccc2C1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-724-216 0.69 O=c1cccc2C3CC(CN(C3)c3nc(NCC4CCCO4)nc(n3)N3CCCC3)Cn12
MolPort-020-231-948 0.69 FC(F)(F)CCc1ccnc(n1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-346-664 0.69 [O-][N+](=O)c1cccc2n(CC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)ccc12
MolPort-044-563-995 0.69 Cc1cc(C)nc(n1)N1CCC(CC1)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-512-870 0.69 COc1ccc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=S)N(C)C2=O)cc1
MolPort-000-793-741 0.69 O=C1NC(=O)C(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2cccc3ccccc23)C(=O)N1Cc1ccccc1
MolPort-046-595-442 0.69 COc1ccc(cc1)C(NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2)C(C)C
MolPort-044-430-885 0.69 COc1ccc(cc1)C(NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(C)C
MolPort-005-972-852 0.69 Cc1ccc2c(CN3CC4CC(C3)c3cccc(=O)n3C4)cc(=O)oc2c1
MolPort-044-543-347 0.69 Cc1ccc2c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc(=O)oc2c1
MolPort-044-524-069 0.69 Oc1ccc(Cl)c(c1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-035-873-929 0.69 CCC(C)C(N1Cc2ccccc2C1=O)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-193-981 0.69 CN1C(=S)N(C)C(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2c(Cl)cccc2Cl)C1=O
MolPort-020-231-948 0.69 FC(F)(F)CCc1ccnc(n1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-347-275 0.69 O=C(CCn1c2CCCCc2c2ccccc12)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-035-701-078 0.69 O=C(CCn1c2CCCCc2c2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-563-936 0.69 CC(C)CNC(=O)[C@@H]1Cc2cc(ccc2N2C[C@H]3C[C@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MolPort-044-175-801 0.69 Nc1ccc2N3C[C@H]4C[C@@H]([C@@H]3[C@@H](Cc2c1)C(O)=O)c1cccc(=O)n1C4
MolPort-046-768-542 0.69 Clc1ccc(nn1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-019-940-204 0.69 Clc1ccc(nn1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-044-231-480 0.69 Cl.OC(=O)c1cccc(n1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-046-140-900 0.69 Fc1c(Cl)ncnc1N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-027-718-714 0.69 Cc1c(C(=O)CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2n1C
MolPort-044-563-995 0.69 Cc1cc(C)nc(n1)N1CCC(CC1)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-597-424 0.69 CC[C@H](C)[C@@H](N1Cc2ccccc2C1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-632-834 0.69 O=C(NCCOC1CCCC1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-044-431-290 0.69 COC(=O)[C@@H](NC(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)C(C)C
MolPort-044-566-399 0.69 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCCn1ccc2ccccc12
MolPort-046-462-580 0.69 Cn1cc(Cl)c(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1
MolPort-046-419-114 0.69 COC(=O)[C@@H](NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(C)C
MolPort-039-346-664 0.69 [O-][N+](=O)c1cccc2n(CC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)ccc12
MolPort-039-193-944 0.69 CCOc1ccc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)cc1
MolPort-044-431-951 0.69 CC(C)CC(N1Cc2ccccc2C1=O)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-044-430-885 0.69 COc1ccc(cc1)C(NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(C)C
MolPort-035-870-003 0.69 COC(=O)[C@H](NC(=O)N1C[C@H]2CC(C1)c1cccc(=O)n1C2)C(C)C
MolPort-046-595-442 0.69 COc1ccc(cc1)C(NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2)C(C)C
MolPort-044-810-020 0.69 COC(=O)[C@@H](NC(=O)N1CC2C[C@@H](C1)c1cccc(=O)n1C2)C(C)C
MolPort-028-856-579 0.69 [O-][N+](=O)c1cccc2n(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12
MolPort-039-194-046 0.69 Brc1ccc(cc1)C(=O)NC(=S)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-005-308-845 0.69 [O-][N+](=O)c1cc(Br)c(NC(=O)CN2CC3CC(C2)c2cccc(=O)n2C3)c(Br)c1
MolPort-016-595-685 0.69 CCOc1ccnc(n1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-194-243 0.69 CC1(C)OC(=O)C(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2cccc3ccccc23)C(=O)O1
MolPort-027-564-811 0.69 COC(=O)[C@H](CC(C)C)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-042-672-010 0.69 O=C(C(Cc1ccccc1)N1Cc2ccccc2C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-027-564-335 0.69 Cc1cc(=O)c(O)c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n1C
MolPort-003-182-327 0.69 O=c1cccc2C3CC(CN(Cc4coc5ccccc5c4=O)C3)Cn12
MolPort-002-512-291 0.69 COc1ccc2ccccc2c1CC1(CN2C[C@@H]3CC(C2)c2cccc(=O)n2C3)C(=O)N(C)C(=O)N(C)C1=O
MolPort-002-514-409 0.69 CC(NC(=O)OCc1ccccc1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-518-389 0.69 NNC(=O)[C@H](Cc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-430-822 0.69 O=C([C@H](Cc1ccccc1)N1Cc2ccccc2C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-431-995 0.69 Cn1ccc2c(OCC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)cccc12
MolPort-016-586-257 0.69 COc1cc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc2OCOc12
MolPort-019-609-050 0.69 O=C(CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)c1ccccc1
MolPort-004-831-605 0.69 Clc1ccc(cc1)C(=O)NC(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-039-193-980 0.69 COc1ccc(cc1)C(=O)\C=C\N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-055-826 0.69 CC(C)CCn1ccc2c(OCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cccc12
MolPort-046-768-578 0.69 O=C(CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)NC1CCS(=O)(=O)C1
MolPort-044-634-909 0.69 Fc1cc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(F)c1F
MolPort-046-596-065 0.69 NNC(=O)C(Cc1ccccc1)NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-056-421 0.69 CC1(C)CCc2cc(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc2O1
MolPort-002-706-262 0.69 Brc1ccc(cc1)C(=O)NC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-015-160-616 0.69 Clc1ccc(cc1)C(=O)NC(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-007-932-424 0.69 OC(=O)c1ccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-004-975-501 0.69 Fc1ccc(cc1)C(=O)NC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-193-947 0.69 Clc1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1Cl
MolPort-002-658-523 0.69 CC1(C)OC(=O)C(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2cccc3ccccc23)C(=O)O1
MolPort-002-514-728 0.69 COc1ccc(\C=C\C(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-029-886-032 0.69 Fc1cccc(CCN2C(=O)N[C@@H](CCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)c1
MolPort-035-874-142 0.69 Cc1nc2ccc(cc2nc1C)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-008-347-555 0.69 Clc1ccc(nn1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-522-314 0.69 COC(=O)[C@H](CC(C)C)NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-046-768-542 0.69 Clc1ccc(nn1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-056-809 0.69 CC(C)Cn1ccc2c(OCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cccc12
MolPort-044-175-801 0.69 Nc1ccc2N3C[C@H]4C[C@@H]([C@@H]3[C@@H](Cc2c1)C(O)=O)c1cccc(=O)n1C4
MolPort-044-431-996 0.69 CC(C)CCn1ccc2c(OCC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)cccc12
MolPort-001-744-639 0.69 CN(C)CC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C3CCN(CC3)C(C)=O)Cn2c1=O
MolPort-002-511-177 0.69 Clc1ccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1Cl
MolPort-002-518-677 0.69 Cc1ccc(C)c(NC(=O)CCNC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MolPort-001-743-104 0.69 O=C(Nc1ccccc1)Nc1ccc2[C@H]3CNC[C@H](C3)Cn2c1=O
MolPort-002-518-270 0.69 Clc1cccc(NC(=O)CCNC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MolPort-039-058-034 0.69 Cn1ccc2c(OCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cccc12
MolPort-001-745-146 0.69 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(NC(=O)C3CCCCC3)ccc(=O)n1C2
MolPort-044-543-346 0.69 Cc1ccc2oc(=O)cc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-039-347-275 0.69 O=C(CCn1c2CCCCc2c2ccccc12)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-009-758-189 0.69 Cl.Cc1cc(Br)c(OCC(O)CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)c(Br)c1
MolPort-000-748-067 0.69 [Cl-].OC(C[NH+]1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)Cn1c2CCCCc2c2ccccc12
MolPort-005-975-829 0.69 Cc1ccc2oc(=O)cc(CN3CC4CC(C3)c3cccc(=O)n3C4)c2c1
MolPort-009-758-197 0.69 Cl.OC(CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)Cn1c2CCCCc2c2ccccc12
MolPort-035-873-689 0.69 Cc1cc(C)nc(n1)N1CCCC(C1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-563-936 0.69 CC(C)CNC(=O)[C@@H]1Cc2cc(ccc2N2C[C@H]3C[C@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MolPort-044-431-997 0.69 CC(C)n1ccc2c(OCC(=O)N3CC4CC(C3)c3cccc(=O)n3C4)cccc12
MolPort-035-701-078 0.69 O=C(CCn1c2CCCCc2c2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-515-000 0.69 Fc1ccc(cc1)C(=O)NC(=S)N1C[C@H]2CC(C1)c1cccc(=O)n1C2
MolPort-044-466-161 0.69 CC1(C)COCCN1CCNC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-027-564-813 0.69 CC[C@@H](C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)OC
MolPort-046-140-900 0.69 Fc1c(Cl)ncnc1N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-001-743-777 0.69 O=c1c(ccc2[C@@H]3C[C@@H](CN(CCCc4ccccc4)C3)Cn12)-c1cccc(c1)C#N
MolPort-028-856-579 0.69 [O-][N+](=O)c1cccc2n(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12
MolPort-006-316-469 0.69 CCC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)OC
MolPort-044-431-951 0.69 CC(C)CC(N1Cc2ccccc2C1=O)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-016-591-267 0.69 CCC(C)C(NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)OC
MolPort-039-193-944 0.69 CCOc1ccc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)cc1
MolPort-044-180-029 0.69 O=C(Cc1ccc2OCCc2c1)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-507-498 0.69 COC(=O)[C@@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(C)C
MolPort-039-106-510 0.69 Cc1cc2c(C)nc(nc2cc1F)N1CCC(CC1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-431-290 0.69 COC(=O)[C@@H](NC(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)C(C)C
MolPort-002-516-305 0.69 Clc1ccc(cc1)C(=O)NC(N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-001-729-559 0.69 O=C(N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)c1c[nH]c2ccccc12
MolPort-000-850-070 0.69 OC(COc1ccc(Cl)cc1Cl)CN1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-510-670 0.69 CC(C)Oc1ccc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)cc1
MolPort-016-591-275 0.69 COC(=O)C(NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2)C(C)C
MolPort-002-511-126 0.69 CCOc1ccc(CC2(CN3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)cc1
MolPort-001-744-292 0.69 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cncnc1
MolPort-035-870-003 0.69 COC(=O)[C@H](NC(=O)N1C[C@H]2CC(C1)c1cccc(=O)n1C2)C(C)C
MolPort-044-566-399 0.69 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCCn1ccc2ccccc12
MolPort-044-632-834 0.69 O=C(NCCOC1CCCC1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-046-419-114 0.69 COC(=O)[C@@H](NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(C)C
MolPort-035-873-929 0.69 CCC(C)C(N1Cc2ccccc2C1=O)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-035-701-565 0.69 CC(C)[C@H](NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCCn1ccc2ccccc12
MolPort-046-462-580 0.69 Cn1cc(Cl)c(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1
MolPort-044-810-020 0.69 COC(=O)[C@@H](NC(=O)N1CC2C[C@@H](C1)c1cccc(=O)n1C2)C(C)C
MolPort-019-940-204 0.69 Clc1ccc(nn1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-044-231-480 0.69 Cl.OC(=O)c1cccc(n1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-001-744-453 0.69 CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)C3CCCCC3)c(=O)n1C2
MolPort-009-745-150 0.69 O=C(N1CC2CC(C1)c1cccc(=O)n1C2)c1cccs1
MolPort-044-431-903 0.69 Cc1cc(C)n(CCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)n1
MolPort-001-743-248 0.69 O=C(C1CCCCC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc4ccccc4c3)c(=O)n1C2
MolPort-046-597-888 0.69 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H]([C@@H]3[C@@H](Cc2c1)C(=O)NCCC(=O)N1CCCc2ccccc12)c1cccc(=O)n1C4
MolPort-044-563-943 0.69 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCC1CC1
MolPort-044-431-365 0.69 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NC[C@@H]1CCCN2CCCC[C@H]12
MolPort-044-543-760 0.69 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NC[C@@H]1CCCN2CCCC[C@H]12
MolPort-044-810-609 0.69 CN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MolPort-000-522-225 0.69 Cc1ccc2oc(=O)cc(N3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-001-743-479 0.69 O=C(C1CCCCC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccnc3)c(=O)n1C2
MolPort-000-384-391 0.69 O=c1cccc2C3CC(CN(C3)c3ncnc4[nH]cnc34)Cn12
MolPort-002-534-498 0.69 COc1ccc(cc1OC)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-007-922-742 0.69 Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(Cl)cc1
MolPort-027-718-774 0.69 CCNC(=O)c1ccc(N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(NC(C)=O)c1
MolPort-042-567-661 0.69 CC(Cc1cccc(C)n1)NC(=O)CCn1c(C)cccc1=O
MolPort-009-757-850 0.69 Cl.Cc1c(C(=O)CN2C[C@H]3CC(C2)c2cccc(=O)n2C3)c2ccccc2n1C
MolPort-039-193-966 0.69 CC(C)CC(N1C(=O)c2ccccc2C1=O)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-513-331 0.69 COc1ccc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=S)N(C)C2=O)c2ccccc12
MolPort-039-193-981 0.69 CN1C(=S)N(C)C(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2c(Cl)cccc2Cl)C1=O
MolPort-002-520-662 0.69 COC(=O)CCCC(NC(=S)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2)C(=O)OC
MolPort-039-194-109 0.69 COC(=O)CCCC(NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)OC
MolPort-039-056-077 0.69 COc1ccc(cc1)C1C(CC(=O)N1C)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-742-868 0.69 CC(C)(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)C3CC3)c(=O)n1C2
MolPort-002-520-022 0.69 CCC(C)[C@H](NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(=O)OC
MolPort-044-464-859 0.69 CN(C)c1ncc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cn1
MolPort-002-513-183 0.69 COc1ccc(cc1)C(=O)\C=C\N1C[C@H]2CC(C1)c1cccc(=O)n1C2
MolPort-035-873-930 0.69 O=C(Cc1n[nH]c(=O)c2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-056-896 0.69 CC(C)n1ccc2c(OCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cccc12
MolPort-000-747-668 0.69 [Cl-].Cc1cc(Br)c(OCC(O)C[NH+]2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(Br)c1
MolPort-001-742-987 0.69 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(CC4CCCCC4)C3)Cn2c1=O)c1ccccc1
MolPort-019-558-410 0.69 O=C(CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)NC1CCCCC1
MolPort-001-746-587 0.69 Cc1ccc(cc1)S(=O)(=O)NC[C@H]1C[C@@H]2CC[N@]1C[C@@H]2CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-193-997 0.69 Cl.CCCCSC1CCCCC1OC(=O)CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-044-431-351 0.69 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)CCCCCn3cccc3)Cn2c1=O
MolPort-002-516-971 0.69 OC(=O)CCC(=O)SC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-000-737-695 0.69 [Cl-].CCCCSC1CCCCC1OC(=O)CC[NH+]1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-005-946-300 0.69 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(NC(C)=O)cc3)c(=O)n1C2
MolPort-046-595-477 0.69 [O-][N+](=O)c1ccc2C3CC(CN(C3)C(=O)CCCCCn3cccc3)Cn2c1=O
MolPort-007-931-546 0.69 O=C(CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)NCc1ccccc1
MolPort-027-718-735 0.69 O=C(CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2OCCOc2c1
MolPort-002-513-227 0.69 CN1C(=S)N(C)C(=O)C(CN2C[C@H]3CC(C2)c2cccc(=O)n2C3)(Cc2c(Cl)cccc2Cl)C1=O
MolPort-002-511-414 0.69 O=C(N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccco1
MolPort-002-510-455 0.69 COc1ccccc1CC1(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(=O)N(C)C(=O)N(C)C1=O
MolPort-016-588-087 0.69 CCOc1ccc(NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-003-055-938 0.69 CCOc1ccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-035-873-310 0.69 O=C(CCc1ccc2OCCc2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-701-315 0.69 Cc1cc(C)n(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n1
MolPort-007-931-528 0.69 CC(NC(=O)CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)c1ccccc1
MolPort-002-524-811 0.69 CC(C)(C)OC(=O)N[C@@H](Cc1ccccc1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-873-660 0.69 CC(=O)c1cn(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-019-808-889 0.69 Cc1nc(nc2cc3CCCc3cc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-179-656 0.69 O=C(NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1c[nH]c(=O)c2ccccc12
MolPort-000-738-845 0.69 [Cl-].Cc1c(C(=O)C[NH+]2C[C@H]3CC(C2)c2cccc(=O)n2C3)c2ccccc2n1C
MolPort-001-743-653 0.69 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccc(c3)C(F)(F)F)c(=O)n1C2
MolPort-002-516-610 0.69 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccco1
MolPort-009-745-164 0.69 O=C(CCS(=O)(=O)c1ccccc1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-533-698 0.69 CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-044-431-953 0.69 CC(=O)c1cn(CC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-046-598-079 0.69 Cc1cc(Br)c(OCC(O)C[NH+]2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(Br)c1
MolPort-002-514-716 0.69 CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(Cl)cc2Cl)C1=O
MolPort-002-519-919 0.69 CC(C)(C)OC(=O)N1CCC[C@H]1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-514-638 0.69 CCOC(=O)CSC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-512-428 0.69 CC(C)CC(N1C(=O)c2ccccc2C1=O)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-004-975-457 0.69 O=C(CSc1nc2ccccc2[nH]1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-193-986 0.69 COc1ccc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=S)N(C)C2=O)c2ccccc12
MolPort-044-565-740 0.69 Oc1nc(CCC(=O)NCCN2CC3CC(C2)c2cccc(=O)n2C3)nc2ccccc12
MolPort-027-718-541 0.69 O=C(CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2OCCCOc2c1
MolPort-027-718-550 0.69 COc1ccc2n(C)c(=O)c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc2c1
MolPort-039-194-157 0.69 CC(C)(C)OC(=O)N1CCC[C@@H]1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-001-744-217 0.69 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc(Cl)cc1
MolPort-035-873-586 0.69 O=C(Cc1ccc2OCCc2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-1281870055 0.69 C12C(OC)=CC3=C(C(C(C)C)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-006-317-101 0.69 COc1ccc(cc1OC)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-2428493632 0.69 C1(C2=CC=CC=C2)=COC2=C(C=CC(OCCCC)=C2)C1=O
MolPort-003-186-695 0.69 O=C(N1CC2CC(C1)c1cccc(=O)n1C2)c1ccco1
MCULE-8574526011 0.69 C1(C2=CC=C3C(OCCCO3)=C2)=COC2C(=CC(=C(OCC(OCC)=O)C=2)CCC)C1=O
MolPort-002-525-869 0.69 CCOc1ccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MCULE-7980159647 0.69 C1(C2=CC=C3C(OCCCO3)=C2)=COC2=C(C=C(C(OC)=C2)CCC)C1=O
MolPort-002-720-629 0.69 O=c1cccc2C3CC(CN(C3)c3nc(NCC4CCCO4)nc(n3)N3CCOCC3)Cn12
MCULE-7271133087 0.69 C12C(O)=CC3=C(C(C(C)C)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-002-520-811 0.69 Fc1ccc2[nH]cc(C(=O)CN3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1
MCULE-3264810500 0.69 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC=CC=3OCCC3=CC=CC=C3)C=21)=O)C1=CC=C(C=C1)O
MolPort-001-743-639 0.69 COc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C3CCN(C)CC3)Cn2c1=O
MCULE-9694457549 0.69 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OC)C=2)CC)C1=O
MolPort-002-513-095 0.69 Cc1c(C(=O)CN2C[C@H]3CC(C2)c2cccc(=O)n2C3)c2ccccc2n1C
MCULE-1693585554 0.69 C1(C2C=CC=CC=2)=COC2=C(C=C(C(O)=C2)CCC)C1=O
MolPort-001-743-719 0.69 O=c1c(ccc2[C@@H]3C[C@@H](CN(Cc4ccccc4)C3)Cn12)-c1cccnc1
MCULE-3664690789 0.69 C1(C2C=CC(=CC=2)Br)=COC2C(=CC=C(OCC(=O)C3C=CC(=CC=3)Br)C=2)C1=O
MolPort-001-743-781 0.69 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccc(c3)C#N)c(=O)n1C2
MCULE-1042504327 0.69 C1(C2=CC=C(C=C2)Br)=COC2=C(C=C(C(OC)=C2)CC)C1=O
MolPort-039-106-510 0.69 Cc1cc2c(C)nc(nc2cc1F)N1CCC(CC1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-5526368911 0.69 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OCC(C)=C)C=2)CC)C1=O
MolPort-044-431-351 0.69 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)CCCCCn3cccc3)Cn2c1=O
MCULE-6540816672 0.69 C1(C2=CC=C(C=C2)F)=COC2=C(C=C(C(OCC(OC)=O)=C2)CC)C1=O
MolPort-046-595-477 0.69 [O-][N+](=O)c1ccc2C3CC(CN(C3)C(=O)CCCCCn3cccc3)Cn2c1=O
MCULE-1381137185 0.69 CCOCC(COC1=CC2=C(C(C(C3=CC=CC=C3)=CO2)=O)C=C1)O
MolPort-039-193-997 0.69 Cl.CCCCSC1CCCCC1OC(=O)CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-2889654578 0.69 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC(=C(OCC(OC)=O)C=2)CC)C1=O
MolPort-039-194-109 0.69 COC(=O)CCCC(NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)OC
MCULE-3944741029 0.69 C12C(O)=CC3=C(C(CC(C)C)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-039-056-077 0.69 COc1ccc(cc1)C1C(CC(=O)N1C)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-9965921788 0.69 C1(=O)C2C=C(CC)C(=CC=2OC(C)=C1C1=CC=CC=C1)OCC
MolPort-044-431-365 0.69 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NC[C@@H]1CCCN2CCCC[C@H]12
MCULE-2636637523 0.69 C12OC=C(C(=O)C1=CC=C(O)C=2C(C1=CC=C(C=C1)OCCC1=CC=C(C=C1)OC)CC(OC)=O)C1=CC=C(C=C1)O
MolPort-044-810-609 0.69 CN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MCULE-5274528788 0.69 C12C(O)=CC3=C(C(CC(C)C)CC(=O)O3)C=1OC=C(C1=CC=CC=C1)C2=O
MolPort-046-597-888 0.69 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H]([C@@H]3[C@@H](Cc2c1)C(=O)NCCC(=O)N1CCCc2ccccc12)c1cccc(=O)n1C4
MCULE-1994821035 0.69 C12C(O)=CC3=C(C(CC(C)C)CC(=O)O3)C=1OC=C(C1=CC=C(C=C1)O)C2=O
MolPort-044-563-943 0.69 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCC1CC1
MolPort-044-543-760 0.69 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NC[C@@H]1CCCN2CCCC[C@H]12
MolPort-027-718-774 0.69 CCNC(=O)c1ccc(N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(NC(C)=O)c1
MolPort-042-567-661 0.69 CC(Cc1cccc(C)n1)NC(=O)CCn1c(C)cccc1=O
MolPort-027-718-735 0.69 O=C(CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2OCCOc2c1
MolPort-027-718-541 0.69 O=C(CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2OCCCOc2c1
MolPort-044-431-953 0.69 CC(=O)c1cn(CC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-044-179-656 0.69 O=C(NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1c[nH]c(=O)c2ccccc12
MolPort-002-735-284 0.68 Cc1ccc(NC(=S)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(Br)c1
MCULE-2520663778 0.68 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=CC=3)OCCC3C=CC(=CC=3)OC)C=21)=O)C1=CC=C(C=C1)O
MolPort-044-564-829 0.68 CC(C)c1ccc(C)cc1OCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-3547313077 0.68 C1(C2=CC=C3C(OCO3)=C2)=COC2=C(C=C(C(OC(C)C)=C2)CCC)C1=O
MolPort-001-744-344 0.68 O=C(C1CC1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccccc1
MCULE-4442959207 0.68 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=CC=3)OCCC3=CC=C4C(CCO4)=C3)C=21)=O)C1C=CC=CC=1
MolPort-030-042-374 0.68 COC(=O)C1(CCCCC1)NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-2097123383 0.68 C1(C2=CC=CC=C2Cl)=COC2C(=CC(=C(OCC)C=2)CC)C1=O
MolPort-002-516-280 0.68 ClC(Cl)(Cl)C(NC(=O)c1ccc(Br)cc1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-1956801576 0.68 CCC1=C(OC(C(OC)=O)C)C=C2C(C(C(C3=CC4=C(OCCO4)C=C3)=CO2)=O)=C1
MolPort-002-160-283 0.68 Cc1ccc2occ(CN3CC4CC(C3)c3cccc(=O)n3C4)c(=O)c2c1
MCULE-5835277658 0.68 C1(C2C=CC3=C(OCO3)C=2)=COC2=C(C=C(C(OCC(O)=O)=C2)CCC)C1=O
MolPort-039-194-002 0.68 COc1ccccc1NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-6996701232 0.68 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC=CC=3OCCC3C=CC4=C(CCO4)C=3)C=21)=O)C1C=CC=CC=1
MolPort-002-509-050 0.68 Clc1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(Cl)c1
MCULE-6917245646 0.68 C1(C2=CC=C3C(OCCCO3)=C2)=COC2C(=CC(=C(OCC(C3C=CC=CC=3)=O)C=2)CC)C1=O
MolPort-002-770-625 0.68 Clc1ccc(cc1)C(=O)NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-4841526892 0.68 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(O)C=2)CC)C1=O
MolPort-009-759-281 0.68 CC(C)N1CC(CC1=O)C(=O)Nc1ccc(nc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-4057836803 0.68 C1(C2C=CC3=C(OCCO3)C=2)=COC2=C(C=C(C(OCC(O)=O)=C2)CC)C1=O
MolPort-002-510-789 0.68 COc1cccc(CNC(=O)CCC(=O)N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)c1OC
MCULE-3016894809 0.68 C1(C2C=CC3=C(OCCO3)C=2)=COC2=C(C=C(C(OCC(OC)=O)=C2)CC)C1=O
MolPort-001-746-595 0.68 O=C(NC[C@H]1C[C@@H]2CC[N@]1C[C@@H]2CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)Nc1cccc(c1)C#N
MCULE-1122354968 0.68 C1(C2=CC=CC=C2)=COC2C(=CC=C(OCC(=O)C3C=CC(=CC=3)F)C=2)C1=O
MolPort-002-519-257 0.68 CCCCc1ccc(NC(=O)[C@H](C)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MCULE-4165787511 0.68 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OCC(OC(C)C)=O)C=2)CC)C1=O
MolPort-001-743-119 0.68 CSCC(=O)Nc1ccc2[C@H]3CNC[C@H](C3)Cn2c1=O
MCULE-5900218198 0.68 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC=C(OCC(C3C=CC=CC=3)=O)C=2)C1=O
MolPort-019-950-411 0.68 Cn1nnc(n1)-c1ccc(NC(=O)CCN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MCULE-5620975172 0.68 C12C(O)=CC3=C(C(C4=CC=C(C=C4)O)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-035-700-045 0.68 Fc1ccc(CCN2C(=O)N[C@@H](CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)cc1
MCULE-4035623924 0.68 C1(=O)C2=CC(CC)=C(C=C2OC(C)=C1C1=CC=C(C=C1)OC)OCC(OCC)=O
MolPort-002-518-269 0.68 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(C)cc1
MCULE-2883311604 0.68 C1(C2C=CC(=CC=2)OC)=COC2C(=CC=C(OCC)C=2)C1=O
MolPort-005-947-078 0.68 OC(=O)C[C@@H]1CCN(C[C@@H]1CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(=O)c1ccnc(Cl)c1
MCULE-9822938232 0.68 C1(C2C=CC(=CC=2)OC)=COC2C(=CC=C(C=2)OC(C(C)C)=O)C1=O
MolPort-042-598-338 0.68 CC(C)N1CCN(CCCN2CCCC(C2)c2ccccn2)CC1
MCULE-2663052506 0.68 C1(OC)C=C2OC=C(C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1
MolPort-044-810-706 0.68 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCc1ccccn1
MCULE-9707115022 0.68 C1(C2=CC=C(C=C2)OC)=C(C)OC2C(=CC=C(OCC(C3C=CC=CC=3)=O)C=2)C1=O
MolPort-027-718-493 0.68 COC(=O)C1(CCCCC1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-3825774686 0.68 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(OCC(C3=CC=CC=C3)=O)C=2)C1=O
MolPort-001-743-740 0.68 CN(C)Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(CC4CCCCC4)C3)Cn2c1=O
MCULE-4566515366 0.68 C12C(OC)=CC3=C(C(CC(C)C)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-009-759-232 0.68 O=C(CCc1ccccc1)Nc1ccc(nc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-4949180754 0.68 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(OCC(C)=C)C=2)C1=O
MolPort-046-598-056 0.68 Ic1ccccc1C(=O)NC(=S)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MCULE-7847565254 0.68 COC1=CC=C(C2C(=O)C3=C(C=C(C=C3)OCCCC3CCCC3)OC=2)C=C1
MolPort-003-055-936 0.68 COc1ccccc1NC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-6222073294 0.68 C12C(O)=CC3=C(C(C4C=CC=CC=4)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-027-718-383 0.68 Cc1cc(C)c2c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc(=O)oc2c1
MCULE-5743640710 0.68 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(OCC(C3=CC=CC=C3)=O)C=2)C1=O
MolPort-002-513-241 0.68 CC(C)c1ccc(CC2(CN3C[C@H]4CC(C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C2=O)c2ccccc2)cc1
MolPort-035-701-362 0.68 Fc1cccc(CCN2C(=O)N[C@@H](CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)c1
MolPort-001-744-646 0.68 COCCC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C3CCN(C)CC3)Cn2c1=O
MolPort-002-519-408 0.68 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(cc1)C(C)C
MolPort-002-529-484 0.68 CCCCc1ccc(NC(=O)[C@@H](NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(C)CC)cc1
MolPort-002-514-189 0.68 Cc1ccc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C2=O)c2ccccc2)cc1
MolPort-005-309-840 0.68 [O-][N+](=O)c1cc(Cl)c(NC(=O)CN2CC3CC(C2)c2cccc(=O)n2C3)c(Cl)c1
MolPort-002-518-127 0.68 CCOc1ccc(NC(=O)CCNC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-046-597-555 0.68 O=C(C1CN(Cc2ccco2)C(=O)C1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-005-947-084 0.68 OC(=O)C[C@@H]1CCN(C[C@@H]1CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(cc1)C(F)(F)F
MolPort-005-947-080 0.68 OC(=O)C[C@@H]1CCN(C[C@@H]1CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(=O)Cc1cccs1
MolPort-044-562-599 0.68 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@H](Cn5c4cccc5=O)C3[C@@H](Cc2c1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-518-650 0.68 CCc1ccc(NC(=O)[C@@H](NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(C)C)cc1
MolPort-002-519-030 0.68 CC(=O)Nc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-028-591-129 0.68 O=C(Cn1ccnc1-c1ccccc1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-510-592 0.68 COc1cc(CNC(=O)CCC(=O)N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)cc(OC)c1OC
MolPort-035-873-810 0.68 O=C(C1CN(Cc2ccco2)C(=O)C1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-518-082 0.68 CCCCc1ccc(NC(=O)[C@@H](NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(C)C)cc1
MolPort-002-517-506 0.68 CC(C)C[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(cc1)C(C)C
MolPort-039-194-532 0.68 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2[nH]c3CCCCc3c2c1
MolPort-000-861-694 0.68 C(C1CCCCN1)c1ccccn1
MolPort-009-705-711 0.68 Cc1cc(C)c2c(CN3CC4CC(C3)c3cccc(=O)n3C4)cc(=O)oc2c1
MolPort-044-810-816 0.68 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-514-346 0.68 [O-][N+](=O)c1cc(C#N)c(cc1N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C#N
MolPort-001-744-343 0.68 O=C(C1CCCCC1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccccc1
MolPort-002-516-319 0.68 CC(=C)c1cccc(c1)C(C)(C)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-195-316 0.68 CC(C)n1cc(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2c1=O
MolPort-039-194-081 0.68 Ic1ccccc1C(=O)NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-001-743-474 0.68 CSc1ccc(cc1)-c1ccc2[C@H]3CNC[C@H](C3)Cn2c1=O
MolPort-035-699-942 0.68 CS(=O)(=O)Nc1cccc2n(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12
MolPort-002-515-635 0.68 OC(=O)c1ccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-007-922-840 0.68 Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N(CC=C)c1ccccc1
MolPort-001-622-386 0.68 [O-][N+](=O)c1cc(C#N)c(cc1N1CC2CC(C1)c1cccc(=O)n1C2)C#N
MolPort-002-520-373 0.68 C[C@@H]1CC[C@H]2C(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)O[C@@]22[C@@H]3O[C@]3(C)CC[C@@H]12
MolPort-044-432-061 0.68 O=C(N1CC2CC(C1)c1cccc(=O)n1C2)C1(CCCCC1)n1cnnn1
MolPort-035-873-535 0.68 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C1(CCCCC1)n1cnnn1
MolPort-009-759-270 0.68 CC(=C)C(=O)Nc1ccc(nc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-768-580 0.68 O=c1cccc2[C@H]3C[C@@H](CN(C3)S(=O)(=O)c3ccccc3)Cn12
MolPort-039-194-052 0.68 COc1ccc2[nH]cc(C(O)CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-002-528-024 0.68 CC(C)C[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCCCOC(C)C
MolPort-044-565-655 0.68 Cc1ccc(OCC(O)CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(CC=C)c1
MolPort-007-981-045 0.68 OC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O
MolPort-002-507-529 0.68 OC(=O)c1ccc(NC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-005-976-848 0.68 Cc1cc2oc(=O)cc(CN3CC4CC(C3)c3cccc(=O)n3C4)c2cc1C
MolPort-027-718-887 0.68 CC(C)c1ccc2oc(=O)cc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-002-741-199 0.68 Fc1ccc(NC(=S)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1Cl
MolPort-044-467-363 0.68 Fc1cc(CNC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)ccc1C#N
MolPort-005-157-357 0.68 O=c1cccc2[C@H]3C[C@H](CN(C3)c3cc(ncn3)C3CCNCC3)Cn12
MolPort-027-718-404 0.68 CC(=O)Nc1cc(ccc1N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCc1ccccc1
MolPort-046-768-591 0.68 O=c1cccc2[C@H]3C[C@@H](CN(C3)c3ccc4nncn4n3)Cn12
MolPort-039-057-639 0.68 CCOC(=O)c1ccc(cc1)N1CC(CC1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-743-830 0.68 O=C(C1CCCCC1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc2ccccc2c1
MolPort-007-923-212 0.68 COc1ccc(CNC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(N)c2)cc1
MolPort-001-744-041 0.68 O=C(C1CCCCC1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cccnc1
MolPort-044-181-274 0.68 O=C(CCCCC1SC[C@@H]2NC(=O)N[C@H]12)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-007-945-265 0.68 CC1CCC2C(C1)C(=O)N(C2=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O
MolPort-027-718-383 0.68 Cc1cc(C)c2c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc(=O)oc2c1
MolPort-039-194-081 0.68 Ic1ccccc1C(=O)NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-194-052 0.68 COc1ccc2[nH]cc(C(O)CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-046-596-428 0.68 COc1ccc2[nH]cc(C(O)CN3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-044-543-348 0.68 Cc1cc2oc(=O)cc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2cc1C
MolPort-035-873-535 0.68 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C1(CCCCC1)n1cnnn1
MolPort-044-432-061 0.68 O=C(N1CC2CC(C1)c1cccc(=O)n1C2)C1(CCCCC1)n1cnnn1
MolPort-002-521-398 0.68 Fc1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1Cl
MolPort-045-890-251 0.68 CC(C)n1ccc(CC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1
MolPort-044-565-846 0.68 Oc1cc(C(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2n1
MolPort-002-522-433 0.68 CSCCC(NC(=S)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2)C(O)=O
MolPort-002-519-534 0.68 COCCCNC(=O)[C@H](Cc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-810-816 0.68 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-514-366 0.68 O=C(CNC(=O)OCc1ccccc1)NCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-003-055-942 0.68 Cc1c(Cl)cccc1NC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-516-681 0.68 COC(=O)[C@H](Cc1ccccc1)NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-038-431-773 0.68 COc1ccc(CCNC(=O)C(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(C)C)cc1
MolPort-039-194-121 0.68 CSCCC(NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O
MolPort-035-700-182 0.68 COc1ccc(CCNC(=O)[C@@H](NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(C)C)cc1
MolPort-046-424-755 0.68 COC(=O)C(Cc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-027-564-812 0.68 COC(=O)[C@H](Cc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-743-643 0.68 Fc1ccc(CN2C[C@@H]3C[C@H](C2)c2ccc(-c4ccc5ccccc5c4)c(=O)n2C3)cc1
MolPort-002-516-410 0.68 ClC(Cl)(Cl)C(NC(=O)Cc1ccccc1)NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-016-621-068 0.68 Cc1nc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cs1
MolPort-009-705-713 0.68 CCc1ccc2oc(=O)cc(CN3CC4CC(C3)c3cccc(=O)n3C4)c2c1
MolPort-002-512-956 0.68 COc1ccc2ccccc2c1CC1(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)C(=O)N(C)C(=S)N(C)C1=O
MolPort-035-874-072 0.68 CC(C)(Oc1ccc(cc1)C1CC1(Cl)Cl)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-042-698-652 0.68 Cc1cccc(F)c1NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-004-975-455 0.68 O=CNc1nnc(s1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-005-946-363 0.68 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(Cl)cc3)c(=O)n1C2
MolPort-044-562-599 0.68 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@H](Cn5c4cccc5=O)C3[C@@H](Cc2c1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-057-639 0.68 CCOC(=O)c1ccc(cc1)N1CC(CC1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-873-810 0.68 O=C(C1CN(Cc2ccco2)C(=O)C1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-035-701-223 0.68 CC(C)CNC(=O)c1ccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-030-042-374 0.68 COC(=O)C1(CCCCC1)NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-044-230-727 0.68 Cc1cncc(C=CC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MolPort-045-953-554 0.68 Cc1nn(C)c(C)c1CCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-598-056 0.68 Ic1ccccc1C(=O)NC(=S)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MolPort-035-699-942 0.68 CS(=O)(=O)Nc1cccc2n(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12
MolPort-044-180-657 0.68 CC1(C)CCc2cc(CC(=O)NCCN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc2O1
MolPort-044-180-479 0.68 CS(=O)(=O)Nc1cccc2n(CC(=O)NCCN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12
MolPort-044-565-655 0.68 Cc1ccc(OCC(O)CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(CC=C)c1
MolPort-039-195-316 0.68 CC(C)n1cc(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2c1=O
MolPort-039-194-002 0.68 COc1ccccc1NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-046-597-555 0.68 O=C(C1CN(Cc2ccco2)C(=O)C1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-768-580 0.68 O=c1cccc2[C@H]3C[C@@H](CN(C3)S(=O)(=O)c3ccccc3)Cn12
MolPort-044-179-958 0.68 O=C(Cc1n[nH]c(=O)c2ccccc12)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-564-829 0.68 CC(C)c1ccc(C)cc1OCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-700-902 0.68 CC(C)CCNC(=O)c1ccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-039-194-060 0.68 ClC(Cl)(Cl)C(NC(=O)c1ccc(Br)cc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-019-950-411 0.68 Cn1nnc(n1)-c1ccc(NC(=O)CCN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-035-700-045 0.68 Fc1ccc(CCN2C(=O)N[C@@H](CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)cc1
MolPort-042-598-338 0.68 CC(C)N1CCN(CCCN2CCCC(C2)c2ccccn2)CC1
MolPort-044-810-706 0.68 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCc1ccccn1
MolPort-027-718-493 0.68 COC(=O)C1(CCCCC1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-510-796 0.68 COc1cc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)ccc1O
MolPort-044-181-274 0.68 O=C(CCCCC1SC[C@@H]2NC(=O)N[C@H]12)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-768-591 0.68 O=c1cccc2[C@H]3C[C@@H](CN(C3)c3ccc4nncn4n3)Cn12
MolPort-035-701-362 0.68 Fc1cccc(CCN2C(=O)N[C@@H](CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)c1
MolPort-028-591-129 0.68 O=C(Cn1ccnc1-c1ccccc1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-194-532 0.68 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2[nH]c3CCCCc3c2c1
MolPort-044-467-363 0.68 Fc1cc(CNC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)ccc1C#N
MolPort-035-814-472 0.68 Cc1cc(C)nc(NCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n1
MolPort-035-874-072 0.68 CC(C)(Oc1ccc(cc1)C1CC1(Cl)Cl)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-038-431-773 0.68 COc1ccc(CCNC(=O)C(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(C)C)cc1
MolPort-027-718-887 0.68 CC(C)c1ccc2oc(=O)cc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-030-042-367 0.68 COC(=O)C(Cc1ccccc1)NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-045-890-251 0.68 CC(C)n1ccc(CC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1
MolPort-035-700-182 0.68 COc1ccc(CCNC(=O)[C@@H](NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(C)C)cc1
MolPort-042-698-652 0.68 Cc1cccc(F)c1NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-027-847-868 0.68 Oc1nc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)nc2ccc(F)cc12
MolPort-044-565-846 0.68 Oc1cc(C(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2n1
MolPort-039-194-121 0.68 CSCCC(NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O
MolPort-044-543-348 0.68 Cc1cc2oc(=O)cc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2cc1C
MolPort-027-564-812 0.68 COC(=O)[C@H](Cc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-424-755 0.68 COC(=O)C(Cc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-027-718-404 0.68 CC(=O)Nc1cc(ccc1N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCc1ccccc1
MolPort-030-042-367 0.68 COC(=O)C(Cc1ccccc1)NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-035-814-472 0.68 Cc1cc(C)nc(NCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n1
MolPort-027-847-868 0.68 Oc1nc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)nc2ccc(F)cc12
MolPort-016-590-864 0.68 OC(=O)c1ccc(NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-039-194-060 0.68 ClC(Cl)(Cl)C(NC(=O)c1ccc(Br)cc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-735-674 0.68 Clc1ccc(cc1)C(=O)NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-743-769 0.68 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(\C=C\c3ccc(Cl)cc3)c(=O)n1C2
MolPort-001-743-825 0.68 COc1ccc(cc1)-c1ccc(=O)n2C[C@@H]3CNC[C@@H](C3)c12
MolPort-044-180-657 0.68 CC1(C)CCc2cc(CC(=O)NCCN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc2O1
MolPort-002-726-250 0.68 Clc1ccc(Nc2nc(Cl)nc(n2)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-039-194-101 0.68 Cc1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(Br)c1
MolPort-002-513-889 0.68 COc1ccccc1NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-194-101 0.68 Cc1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(Br)c1
MolPort-002-519-474 0.68 Cc1ccc(OCC(O)CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)c(CC=C)c1
MolPort-002-514-625 0.68 CC(C)c1ccc(C)cc1OCC(=O)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MolPort-044-179-958 0.68 O=C(Cc1n[nH]c(=O)c2ccccc12)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-596-428 0.68 COc1ccc2[nH]cc(C(O)CN3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1
MCULE-2834238047 0.68 C12OC=C(C(=O)C1=CC=C1OC(CC(C3=CC=C(C=C3)OCCC3=CC=C4C(CCO4)=C3)C=21)=O)C1=CC=C(C=C1)O
MolPort-005-034-352 0.68 Cc1cc(=O)[nH]c(n1)-c1cccc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MCULE-7863568080 0.68 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OCC3C=CC(=CC=3)OC)C=2)CCC)C1=O
MolPort-044-230-727 0.68 Cc1cncc(C=CC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MCULE-8118231557 0.68 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(C=2)OC(=O)C(C)(C)C)C1=O
MolPort-044-180-479 0.68 CS(=O)(=O)Nc1cccc2n(CC(=O)NCCN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12
MCULE-8780516542 0.68 C1(C2=CC=C3C(OCCCO3)=C2)=COC2=C(C=C(C(OC(C)C(OC)=O)=C2)CCC)C1=O
MolPort-035-700-902 0.68 CC(C)CCNC(=O)c1ccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MCULE-4241728982 0.68 C1(C2C=CC=CC=2)=COC2=C(C=CC(OC(C)C)=C2)C1=O
MolPort-045-953-554 0.68 Cc1nn(C)c(C)c1CCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-8865767480 0.68 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC=CC=3OCCC3C=CC4=C(CCO4)C=3)C=21)=O)C1=CC=C(C=C1)O
MolPort-035-701-223 0.68 CC(C)CNC(=O)c1ccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MCULE-3891408736 0.68 C1(C2C=CC3=C(OCCCO3)C=2)=COC2=C(C=C(C(O)=C2)CCC)C1=O
MolPort-002-525-538 0.68 CC(=O)c1cccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MCULE-1777101277 0.68 C1(=O)OC2=CC(=CC=C2C=C1C1=CC=C(C=C1)OC)OC(C)C(C1=CC=CC=C1)=O
MolPort-001-746-581 0.67 O=C(NC[C@H]1C[C@@H]2CC[N@]1C[C@@H]2CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccco1
MolPort-000-858-437 0.67 Cc1cc(NC(=O)CCNC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)ccc1Br
MolPort-006-808-103 0.67 CC(=O)Nc1ccc2n(C)c(CN3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)nc2c1
MolPort-001-744-968 0.67 CN(C)CC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)CC(C)(C)C)Cn2c1=O
MolPort-027-718-100 0.67 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCCCCC1
MolPort-001-743-210 0.67 O=C(Nc1ccc2[C@H]3CNC[C@H](C3)Cn2c1=O)c1ccncc1
MolPort-044-179-580 0.67 O=C(NCCN1CC2CC(C1)c1cccc(=O)n1C2)C1CN(Cc2ccco2)C(=O)C1
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MolPort-005-310-220 0.67 OCC1OC(C(O)C(O)C1O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-001-744-873 0.67 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)NC3CCCCC3)c(=O)n1C2
MolPort-002-518-578 0.67 Cc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-002-517-596 0.67 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(F)cc1
MolPort-001-744-450 0.67 CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)Cc3ccccc3)c(=O)n1C2
MolPort-039-056-099 0.67 O=C(CC[C@@H]1NC(=O)N(C1=O)c1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-517-510 0.67 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1cccc(C)c1
MolPort-008-326-611 0.67 C(C1CCCCCN1)c1ccccn1
MolPort-035-873-525 0.67 COc1ccc(N2CC(CC2=O)C(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c(OC)c1
MolPort-046-748-954 0.67 O=c1cccc2[C@@H]3C[C@@H](CN(C3)c3ncnc4cc[nH]c34)Cn12
MolPort-046-597-513 0.67 COc1ccc(N2CC(CC2=O)C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(OC)c1
MolPort-002-517-959 0.67 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCCC1=CCCCC1
MolPort-044-181-216 0.67 COCCn1ccc2c(cccc12)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-743-383 0.67 Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)C3CCCCC3)Cn2c1=O
MolPort-002-929-875 0.67 COc1ccc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)cc1OC
MolPort-044-543-991 0.67 O=C(CCNC(=O)c1cnccn1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-514-497 0.67 COc1ccc2[nH]cc(C(=O)CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-003-055-573 0.67 FC(F)Oc1ccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-004-831-622 0.67 ClC(Cl)(Cl)C(NC(=O)c1ccccc1Br)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-511-159 0.67 Cn1c2ncn(CCN3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c(=O)n(C)c1=O
MolPort-039-194-035 0.67 COc1ccc2[nH]cc(C(=O)CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-039-194-086 0.67 COC(=O)c1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-007-981-044 0.67 [O-][N+](=O)c1cc(ccc1F)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-027-718-649 0.67 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCCCC1
MolPort-002-512-318 0.67 CCOP(=O)(OCC)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-046-107-124 0.67 CC(NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1c(F)cncc1F
MolPort-045-985-691 0.67 CC(C)c1ccc(nc1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-512-338 0.67 O=C(COc1ccccc1)N[C@@H](Cc1ccccc1)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-744-898 0.67 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccccc1F
MolPort-005-976-215 0.67 Cc1ccc2c(CN3CC4CC(C3)c3cccc(=O)n3C4)cc(=O)oc2c1C
MolPort-007-932-915 0.67 CCC(C)NC(=O)c1ccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-039-194-079 0.67 O=C(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)\C=C\c1ccccc1
MolPort-044-543-349 0.67 Cc1ccc2c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc(=O)oc2c1C
MolPort-027-718-022 0.67 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCCC1
MolPort-001-743-708 0.67 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(OC(F)(F)F)cc3)c(=O)n1C2
MolPort-001-743-745 0.67 O=c1c(ccc2[C@@H]3C[C@@H](CN(Cc4ccccc4)C3)Cn12)-c1cncnc1
MolPort-046-139-859 0.67 COc1c(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cnn1C
MolPort-001-743-737 0.67 CN(C)Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(CCCc4ccccc4)C3)Cn2c1=O
MolPort-001-743-731 0.67 CN(C)Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(Cc4ccccc4)C3)Cn2c1=O
MolPort-000-705-982 0.67 [Cl-].CC(C)C(=O)OC(COc1ccccc1)C[NH+]1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-743-721 0.67 Fc1ccc(CN2C[C@@H]3C[C@H](C2)c2ccc(-c4cccnc4)c(=O)n2C3)cc1
MolPort-007-570-666 0.67 Clc1nc(NCCN2CCOCC2)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-784-927 0.67 CCOC(=O)C(Cc1ccccc1)NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-543-344 0.67 COc1ccc(cc1)C(=O)NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-019-811-454 0.67 COc1ccc2c(C)nc(nc2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-042-600-622 0.67 Cn1cc(Cl)cc1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-029-886-415 0.67 COc1ccc(CCN2C(=O)N[C@@H](CCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)cc1
MolPort-046-482-370 0.67 Cc1cc(cnn1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-035-873-734 0.67 O=C(N1CC2CC(C1)c1cccc(=O)n1C2)c1ccc(Cn2cnnn2)cc1
MolPort-002-747-883 0.67 Cc1cc(C)nc(NC(=N)N2CC3CC(C2)c2cccc(=O)n2C3)n1
MolPort-002-742-806 0.67 COC(=O)Cc1ccc(NC(=S)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-003-046-381 0.67 Cc1[nH]c2ccccc2c1C(=O)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-046-597-576 0.67 O=C(CCCn1nnc2ccccc2c1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-514-819 0.67 COc1ccc(cc1)C(=O)NC(=S)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MolPort-006-817-060 0.67 [Cl-].CC(C)(C)c1ccc(cc1)[S+]([O-])(=O)CC[NH+]1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-521-928 0.67 CCOC(=O)C(Cc1ccccc1)NC(=S)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MolPort-002-535-798 0.67 Cc1cc(C)nc(NC(=N)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n1
MolPort-000-786-826 0.67 ClC(Cl)(Cl)C(NC(=O)Cc1cccc2ccccc12)NC(=S)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-519-618 0.67 C[C@H](NC(=O)[C@@H](Cc1ccccc1)NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-194-045 0.67 O=C(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1cccnc1
MolPort-001-743-013 0.67 COCCC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(CCCc4ccccc4)C3)Cn2c1=O
MolPort-002-518-353 0.67 CCc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-008-347-747 0.67 CC(C)C(=O)Nc1ccc2n(C)c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)nc2c1
MolPort-046-423-955 0.67 C[C@@H](C(=O)N1C[C@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2)c1ccc(C[C@@H]2CCCC2=O)cc1
MolPort-002-518-406 0.67 CCCCc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-044-543-857 0.67 C[C@@H](C(=O)N1C[C@@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2)c1ccc(C[C@@H]2CCCC2=O)cc1
MolPort-001-746-597 0.67 CSc1cccc(NC(=O)NC[C@H]2C[C@@H]3CC[N@]2C[C@@H]3CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MolPort-044-179-580 0.67 O=C(NCCN1CC2CC(C1)c1cccc(=O)n1C2)C1CN(Cc2ccco2)C(=O)C1
MolPort-000-801-469 0.67 CCc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@H]3CC(C2)c2cccc(=O)n2C3)(Cc2ccc(cc2)C(C)C)C1=O
MolPort-001-744-333 0.67 CC(=O)Nc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(CCCc4ccccc4)C3)c12
MolPort-002-518-660 0.67 CC(C)c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-029-885-616 0.67 O=C(C[C@@H]1NC(=O)N(Cc2ccccc2)C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-746-591 0.67 Clc1ccc(cc1)S(=O)(=O)NC[C@H]1C[C@@H]2CC[N@]1C[C@@H]2CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-046-424-286 0.67 COCCCNC(=O)C1Cc2cc(NC(C)=O)ccc2N2C[C@H]3C[C@@H](C12)c1cccc(=O)n1C3
MolPort-046-681-907 0.67 COCCCNC(=O)[C@@H]1Cc2cc(NC(C)=O)ccc2N2C[C@H]3C[C@@H]([C@H]12)c1cccc(=O)n1C3
MolPort-044-566-719 0.67 O=C(NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2[nH]c3CCCCCc3c2c1
MolPort-045-956-922 0.67 COc1nccnc1N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-007-921-054 0.67 CCC(C)NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(cc2)N(CC)CC)c1
MolPort-007-922-935 0.67 CN(CCc1ccccn1)Cc1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(cc2)C(C)(C)C)c1
MolPort-002-522-586 0.67 CC1=C2C[C@H]3[C@@H](C[C@@]2(C)CCC1)OC(=O)C3CN1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-000-797-803 0.67 CCCCCCCCOc1ccc(CC2(CN3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)cc1
MolPort-007-922-323 0.67 CC(C)NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O
MolPort-001-744-374 0.67 Fc1ccc(CN2C[C@@H]3C[C@H](C2)c2c(ccc(=O)n2C3)-c2ccccc2)cc1
MolPort-000-807-799 0.67 CN1C(=O)N(C)C(=O)C(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2ccc(OCc3ccccc3)cc2)C1=O
MolPort-039-009-486 0.67 Oc1coc(CN2CC3CC(C2)c2cccc(=O)n2C3)cc1=O
MolPort-005-946-369 0.67 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(NC(=O)Nc3ccccc3)ccc(=O)n1C2
MolPort-046-597-518 0.67 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc(Cn2cnnn2)cc1
MolPort-035-873-560 0.67 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cc(nc2ccccc12)-c1ccncc1
MolPort-001-743-545 0.67 O=C(N1C[C@@H]2C[C@H](C1)c1ccc(C3CCCCC3)c(=O)n1C2)c1ccc(cc1)C#N
MolPort-039-345-763 0.67 CCCCc1ccc(NC(=O)C(Cc2ccccc2)NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-006-317-103 0.67 COc1cc(cc(OC)c1OC)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-000-803-698 0.67 CCc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2cccc3ccccc23)C1=O
MolPort-002-534-507 0.67 COc1cc(cc(OC)c1OC)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-566-112 0.67 CCOc1ccccc1CC1(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(=O)N(C)C(=O)N(C)C1=O
MolPort-006-818-723 0.67 Cn1c(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)nc2cc(ccc12)[N+]([O-])=O
MolPort-001-743-482 0.67 CN(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccnc3)c(=O)n1C2
MolPort-002-516-293 0.67 ClC(Cl)(Cl)C(NC(=O)c1ccccc1Br)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-516-823 0.67 ClC(Cl)(Cl)C(NC(=O)Cc1cccc2ccccc12)NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-516-161 0.67 Clc1cccc(c1)C(=O)NC(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-039-193-946 0.67 Cn1c2ncn(CCN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c(=O)n(C)c1=O
MolPort-002-511-629 0.67 CN1C(=O)N(C)C(=O)C(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(OCC=C)cc2)C1=O
MolPort-044-543-753 0.67 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)CCCn3cccc3)Cn2c1=O
MolPort-044-565-662 0.67 CN1C(=O)N(C)C(=O)C(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2ccc(OCC=C)cc2)C1=O
MolPort-046-598-048 0.67 COC(=O)c1ccc(NC(=S)N2C[C@@H]3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-002-511-585 0.67 CCOc1ccccc1CC1(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)C(=O)N(C)C(=O)N(C)C1=O
MolPort-027-718-356 0.67 CC1CCN(Cc2c(O)c(=O)cc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)n2C)CC1
MolPort-027-718-260 0.67 O=c1cccc2[C@H]3C[C@H](CN(Cc4cc(=O)n5ccccc5n4)C3)Cn12
MolPort-002-509-165 0.67 CC(C)OP(=O)(OC(C)C)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-634-805 0.67 COc1cc(cc(OC)c1OC)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-029-885-866 0.67 O=C(CC[C@@H]1NC(=O)N(Cc2ccccc2)C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-744-196 0.67 COc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(CCCc4ccccc4)C3)c12
MolPort-046-596-599 0.66 Cc1occc1C(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-045-955-042 0.66 Cc1cc(C)c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(c1)-n1cccn1
MolPort-039-057-606 0.66 COc1ccc(OC)c(c1)N1CC(CC1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-598-049 0.66 CCOC(=O)c1ccc(NC(=S)N2C[C@@H]3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-035-701-510 0.66 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)N1CCc2ccccc2C1
MolPort-044-701-543 0.66 CC(=O)c1cc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n(C)c1
MolPort-028-855-216 0.66 Clc1ccc(cc1)C(CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)Cn1cnnn1
MolPort-028-856-619 0.66 C[C@H](C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cnc2ccccc2c1=O
MolPort-044-565-139 0.66 Oc1nnc(CC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-038-429-944 0.66 CC(C)c1cc(n[nH]1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-194-171 0.66 OC(=O)C(N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)c1c[nH]c2ccccc12
MolPort-046-595-478 0.66 Oc1ccc(CCNC(=O)C2Cc3cc(ccc3N3CC4CC(Cn5c4cccc5=O)C23)[N+]([O-])=O)cc1
MolPort-039-193-973 0.66 COc1ccc(\C=C\C(=O)C23CC4CC(CC(C4)C2)C3)cc1CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-044-566-083 0.66 CCOc1cc(CC2(CN3CC4CC(C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)ccc1O
MolPort-046-423-995 0.66 COc1ccc(\C=C\C(=O)C23CC4CC(CC(C4)C2)C3)cc1CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-193-904 0.66 COc1cccc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)c1OC
MolPort-039-347-742 0.66 O=C(Cn1cnc2ccccc2c1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-513-809 0.66 CN1C(=O)N(C)C(=O)C(CN2CC3CC(C2)c2cccc(=O)n2C3)(Cc2cn(C)c3ccccc23)C1=O
MolPort-029-885-545 0.66 COc1ccc(CCN2C(=O)N[C@@H](CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)cc1
MolPort-001-744-911 0.66 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccc(c3)C(F)(F)F)c(=O)n1C2
MolPort-039-193-903 0.66 Cc1c(CCNC(=O)CCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c2ccccc2n1-c1ccccc1
MolPort-044-565-139 0.66 Oc1nnc(CC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-030-060-637 0.66 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1cnc2CCCCc2c1
MolPort-027-846-252 0.66 Oc1nc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)nc2cc(Cl)ccc12
MolPort-039-034-939 0.66 COCc1nc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)no1
MolPort-046-597-800 0.66 [O-][N+](=O)c1ccc2[C@H]3C[C@@H](CN(C3)C(=O)CCn3ccc4ccccc34)Cn2c1=O
MolPort-046-778-646 0.66 Cc1nsnc1C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-700-935 0.66 COc1cn(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(C)cc1=O
MolPort-042-645-573 0.66 Oc1nnc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-038-428-782 0.66 CC(C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cnc2ccccc2c1=O
MolPort-046-476-058 0.66 CC(NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1nnnn1C
MolPort-044-543-350 0.66 Cc1cc(C)c2oc(=O)cc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-030-042-363 0.66 COC(=O)c1ccc(NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-027-718-651 0.66 Cc1cccc2nc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc(=O)n12
MolPort-027-718-745 0.66 OC(=O)[C@@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccccc1
MolPort-044-230-865 0.66 CC(C)OCc1cccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MolPort-020-256-612 0.66 CSCC[C@H](NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O
MolPort-002-509-772 0.66 COc1ccc(OC)c(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)c1
MolPort-030-042-379 0.66 OC(=O)C(NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2)c1ccccc1
MolPort-001-743-687 0.66 Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(C3)C3CCOCC3)Cn2c1=O
MolPort-002-742-780 0.66 O=c1cccc2C3CC(CN(C3)C(=S)NCc3ccco3)Cn12
MolPort-028-855-216 0.66 Clc1ccc(cc1)C(CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)Cn1cnnn1
MolPort-002-519-009 0.66 CCCCOCCCNC(=O)[C@H](C)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-744-236 0.66 Fc1ccc(CN2C[C@@H]3C[C@H](C2)c2c(ccc(=O)n2C3)-c2ccccc2F)cc1
MolPort-003-065-899 0.66 Nc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-001-743-834 0.66 CN(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc2ccccc2c1
MolPort-000-850-811 0.66 O=C(Cn1cnc2ccccc2c1=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-347-099 0.66 CC(C(=O)N1CC2CC(C1)c1cccc(=O)n1C2)n1cnc2ccccc2c1=O
MolPort-007-932-579 0.66 CCCCNC(=O)c1ccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-046-598-049 0.66 CCOC(=O)c1ccc(NC(=S)N2C[C@@H]3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-042-645-573 0.66 Oc1nnc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-002-514-185 0.66 CCOc1cc(CC2(CN3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)ccc1O
MolPort-009-745-142 0.66 O=C(Cn1cnc2ccccc2c1=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-004-931-164 0.66 Cc1cc(C)c2oc(=O)cc(CN3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-006-316-352 0.66 CSCC[C@@H](NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O
MolPort-028-856-619 0.66 C[C@H](C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cnc2ccccc2c1=O
MolPort-002-513-157 0.66 CCOc1ccccc1CC1(CN2C[C@H]3CC(C2)c2cccc(=O)n2C3)C(=O)N(C)C(=S)N(C)C1=O
MolPort-002-516-182 0.66 COc1ccc(cc1)C(=O)NC(N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-002-514-453 0.66 Cc1ccc(cc1)S(=O)(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-019-556-075 0.66 O=C(CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)Nc1ccc2ccccc2c1
MolPort-001-744-376 0.66 O=c1ccc(-c2ccccc2)c2[C@@H]3C[C@@H](CN(Cc4cnc5ccccc5c4)C3)Cn12
MolPort-002-518-380 0.66 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1cccc(F)c1
MolPort-007-932-956 0.66 O=C(NCc1ccccc1)c1ccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-002-519-205 0.66 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccccc1F
MolPort-046-065-881 0.66 Nc1ccc(cc1)S(=O)(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-744-460 0.66 CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)c3ccncc3)c(=O)n1C2
MolPort-039-194-094 0.66 Fc1ccc(cc1F)C(=O)NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-517-515 0.66 Cc1cccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MolPort-027-718-056 0.66 Oc1ccc2c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc(=O)oc2c1
MolPort-001-743-489 0.66 O=C(NC1CCCCC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccnc3)c(=O)n1C2
MolPort-044-180-103 0.66 O=C(CC(c1ccsc1)n1cccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-194-162 0.66 O=C(CCCc1cn(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12)N1CCCCCC1
MolPort-002-516-313 0.66 [O-][N+](=O)c1ccc(cc1)C(=O)NC(N1C[C@@H]2CC(C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-039-194-108 0.66 COC(=O)CC(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(=O)OC
MolPort-046-596-599 0.66 Cc1occc1C(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-741-220 0.66 COC(=O)CC(NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)OC
MolPort-001-743-771 0.66 O=c1c(ccc2[C@@H]3C[C@@H](CN(Cc4ccccc4)C3)Cn12)-c1cccc(c1)C#N
MolPort-005-947-077 0.66 OC(=O)C[C@@H]1CCN(C[C@@H]1CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(=O)c1cccs1
MolPort-002-515-905 0.66 COc1ccc(\C=C\C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1O
MolPort-001-743-682 0.66 Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(Cc4ccc(F)cc4)C3)Cn2c1=O
MolPort-002-507-258 0.66 CSCC[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O
MolPort-042-576-253 0.66 O=C(NCCc1cccc(=O)[nH]1)[C@@H]1CCCN2CCCC[C@H]12
MolPort-030-042-363 0.66 COC(=O)c1ccc(NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-009-705-712 0.66 Cc1cc(C)c2oc(=O)cc(CN3CC4CC(C3)c3cccc(=O)n3C4)c2c1
MolPort-046-476-058 0.66 CC(NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1nnnn1C
MolPort-001-743-642 0.66 COc1ccc(CN2C[C@@H]3C[C@H](C2)c2ccc(-c4ccc5ccccc5c4)c(=O)n2C3)cc1
MolPort-020-256-612 0.66 CSCC[C@H](NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O
MolPort-005-975-843 0.66 OC(=O)C(N1CC2CC(C1)c1cccc(=O)n1C2)c1c[nH]c2ccccc12
MolPort-002-518-234 0.66 CCc1ccccc1NC(=O)[C@@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(C)C
MolPort-046-768-584 0.66 Cl.Clc1ccc(s1)C(=O)CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-700-562 0.66 CC(C)c1cc([nH]n1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-516-855 0.66 CCOC(=O)c1ccc(NC(=S)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-030-060-637 0.66 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1cnc2CCCCc2c1
MolPort-044-180-680 0.66 [O-][N+](=O)c1ccc2C3C[C@@H](CN(C3)C(=O)CCn3ccc4ccccc34)Cn2c1=O
MolPort-001-743-755 0.66 O=c1c(ccc2[C@@H]3C[C@@H](CN(Cc4cccs4)C3)Cn12)C1CCCCC1
MolPort-027-564-379 0.66 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCC(Cc2ccccc2)CC1
MolPort-039-034-939 0.66 COCc1nc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)no1
MolPort-044-430-588 0.66 C[C@@H](C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cnc2ccccc2c1=O
MolPort-007-920-875 0.66 CC1CCCC(C)N1C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O
MolPort-035-701-510 0.66 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)N1CCc2ccccc2C1
MolPort-001-743-544 0.66 Fc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1ccc(C3CCCCC3)c(=O)n1C2
MolPort-019-558-471 0.66 O=C(CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)Nc1ccccc1
MolPort-006-827-742 0.66 O=CN1CC2CC(C1)n1c(C2)cccc1=O
MolPort-042-645-052 0.66 [O-][N+](=O)c1ccc2C3CC(CN(C3)C(=O)CCn3ccc4ccccc34)Cn2c1=O
MolPort-027-564-005 0.66 COC(=O)c1ccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-007-922-590 0.66 CCCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O
MolPort-044-632-846 0.66 O=C(NCCOc1ccc(cc1)C#N)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-000-854-867 0.66 COc1ccc(\C=C\C(=O)C23CC4CC(CC(C4)C2)C3)cc1CN1CC2CC(C1)c1cccc(=O)n1C2
MolPort-046-778-646 0.66 Cc1nsnc1C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-423-995 0.66 COc1ccc(\C=C\C(=O)C23CC4CC(CC(C4)C2)C3)cc1CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-598-223 0.66 Nc1ccc(cc1)S(=O)(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-057-606 0.66 COc1ccc(OC)c(c1)N1CC(CC1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-527-863 0.66 CCCCOCCCNC(=O)[C@@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(C)CC
MolPort-007-922-992 0.66 CCN(C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(cc2)C(C)(C)C)c1)c1cccc(C)c1
MolPort-035-873-700 0.66 COCCn1cc(CCCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-007-920-882 0.66 CC(C)CNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O
MolPort-002-518-260 0.66 COCCNC(=O)[C@H](Cc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-007-920-881 0.66 CCCN(CCC)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O
MolPort-027-846-058 0.66 Cc1ccc(cc1)S(=O)(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-512-905 0.66 COc1ccc(\C=C\C(=O)C23CC4CC(CC(C4)C2)C3)cc1CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-000-769-204 0.66 Oc1cc(O)nc(SCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)n1
MolPort-009-705-584 0.66 O=c1n2CCCCCc2cc2ccccc12
MolPort-046-455-664 0.66 O=c1cccc2[C@@H]3C[C@@H](CN(Cc4cn(CC5CC5)nn4)C3)Cn12
MolPort-002-508-533 0.66 Cc1c(CCNC(=O)CCC(=O)N2C[C@@H]3CC(C2)c2cccc(=O)n2C3)c2ccccc2n1-c1ccccc1
MolPort-001-744-921 0.66 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccc(c3)C#N)c(=O)n1C2
MolPort-001-744-645 0.66 COCCC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C3CCN(CC3)C(C)=O)Cn2c1=O
MolPort-039-347-742 0.66 O=C(Cn1cnc2ccccc2c1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-521-871 0.66 O=C(CCC(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)NCc1ccc2OCOc2c1
MolPort-005-977-763 0.66 [O-][N+](=O)c1ccc(cc1)C(=O)NC(N1CC2CC(C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-002-518-806 0.66 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1cc(C)cc(C)c1
MolPort-046-595-478 0.66 Oc1ccc(CCNC(=O)C2Cc3cc(ccc3N3CC4CC(Cn5c4cccc5=O)C23)[N+]([O-])=O)cc1
MolPort-005-910-928 0.66 CNC(=O)C(=O)Nc1ccccc1C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-543-776 0.66 Oc1ccc(CCNC(=O)[C@@H]2Cc3cc(ccc3N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@@H]23)[N+]([O-])=O)cc1
MolPort-001-744-643 0.66 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)c3ccncc3)c(=O)n1C2
MolPort-044-563-942 0.66 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCC=C
MolPort-016-606-637 0.66 CCn1nc(C)c(NC(=O)CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1C
MolPort-044-431-355 0.66 Oc1ccc(CCNC(=O)[C@@H]2Cc3cc(ccc3N3C[C@H]4C[C@H](Cn5c4cccc5=O)[C@@H]23)[N+]([O-])=O)cc1
MolPort-002-518-006 0.66 C[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1cccc(F)c1
MolPort-045-925-427 0.66 O=C(CCc1n[nH]c2CCCCc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-8002308579 0.66 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(OCC(OCC)=O)C=2)C1=O
MolPort-001-746-599 0.66 O=c1cccc2[C@@H]3C[C@@H](CN(C[C@H]4C[N@@]5CC[C@H]4C[C@@H]5CNC(=S)NCc4ccco4)C3)Cn12
MolPort-030-047-978 0.66 Cc1cccc(=O)n1CCC(=O)N1CC(C1)c1ccccn1
MCULE-7431720121 0.66 C1(C2=CC=CC=C2)=COC2C(=CC=C(OCC(O)=O)C=2)C1=O
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MolPort-046-140-830 0.66 O=C(CCn1ccccc1=O)N1CCC[C@@H]1CCc1ccccn1
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MCULE-1263440324 0.66 C1(C2=CC=C(C=C2)Br)=COC2C(=CC=C(OCC(=O)C3C=CC(=CC=3)F)C=2)C1=O
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MolPort-046-598-075 0.66 Cn1c2ncn(CC(O)C[NH+]3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c(=O)n(C)c1=O
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MCULE-2945218977 0.66 C12C(O)=CC3=C(C(C4=CC=C(C=C4)OCCC4=CC=C(C=C4)OC)CC(=O)O3)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
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MolPort-042-671-928 0.66 O=C(COc1ccc2OCOc2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
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MCULE-8651816514 0.66 C1(=COC2=C(C=C(C(OCC(OC)=O)=C2)CCCC)C1=O)C1=CC2=C(C=CC=C2)O1
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MCULE-9549486145 0.66 C12C(OC)=CC3=C(C(CC(=O)O3)C3C=CC(=CC=3OC)OC)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
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MolPort-044-632-892 0.66 COc1ncccc1CCNC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-4723587765 0.66 C12C(OC)=CC3=C(C(C4=CC=CC=C4)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
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MCULE-4621443495 0.66 C12C(OC)=CC3=C(C(C4C=CC(=CC=4)OC)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
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MCULE-3966307782 0.66 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=CC=3OC)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-002-514-891 0.66 COc1ccc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)c(OC)c1
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MCULE-5920010348 0.66 C12C(O)=CC3=C(C(C4=CC=C(C=C4)C(C)C)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
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MolPort-044-563-939 0.66 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCc1ccncc1
MCULE-2073807860 0.66 C12C(OC)=CC3=C(C(C4=CC=C(C=C4)OC(C)C)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-002-514-084 0.66 COc1ccc(CC2(CN3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C)C2=O)c(OC)c1
MolPort-046-597-196 0.66 O=c1cccc2[C@H]3C[C@H](CN(Cc4nnnn4-c4ccccc4)C3)Cn12
MCULE-5645727019 0.66 C12C(O)=CC3=C(C(C4C=CC(=CC=4)OCCCCCCCC)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-044-701-543 0.66 CC(=O)c1cc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n(C)c1
MolPort-044-811-086 0.66 CN1CCN(CC1)C(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MCULE-1363727364 0.66 C1(=O)C2=CC(CC)=C(C=C2OC(C)=C1C1=CC=C(C=C1)OC)OCC1=CC=CC=C1
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MolPort-039-194-005 0.66 COc1ccc(CNC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1OC
MCULE-4230577819 0.66 C12C(O)=CC3=C(C(CC(=O)O3)C3C(OC)=CC(=CC=3OC)OC)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-039-194-082 0.66 CCOC(=O)c1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-002-009-533 0.66 Cc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-4930215498 0.66 C12C(O)=CC3=C(C(CC(=O)O3)C3=CC=CC=C3OCC(OC)=O)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-007-932-423 0.66 CCOC(=O)c1ccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-039-193-978 0.66 CCOc1ccccc1CC1(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)C(=O)N(C)C(=S)N(C)C1=O
MCULE-7540072021 0.66 C12OC=C(C(=O)C1=CC=C(OC)C=2C(C1=CC=C(C=C1)OC(C)C)CC(OC)=O)C1=CC=C(C=C1)OC
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MolPort-008-347-155 0.66 COc1ccc(cc1Cl)N1CC(CC1=O)C(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-8944950672 0.66 C12OC=C(C(=O)C1=CC=C(O)C=2C(C1=CC=C(C=C1)OCC(C)C)CC(OC)=O)C1=CC=C(C=C1)O
MolPort-002-514-827 0.66 COP(=O)(OC)C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccccc1
MolPort-005-977-232 0.66 CSCCC(NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2)C(O)=O
MCULE-5318957279 0.66 C12C(O)=CC3=C(C(C4C=CC(=CC=4)OCC(OC)=O)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-002-722-291 0.66 COc1nc(NCCC2=CCCCC2)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2
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MCULE-7516049920 0.66 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=CC=3OC)OC)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-008-347-614 0.66 CC(C)CC(=O)Nc1ccc2n(C)c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)nc2c1
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MCULE-2419207024 0.66 C12C=C(CC)C(OC(=O)C)=CC=1OC(C)=C(C1C=CC=CC=1)C2=O
MolPort-039-035-486 0.66 C(Cc1ccccn1)C1CCCCN1CCc1ccccn1
MolPort-002-513-917 0.66 COc1ccc(CNC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1OC
MCULE-8227115631 0.66 C12C(=O)C(=COC1=CC(=CC=2OC(=O)C)OC(=O)C)C1=CC=C(OC(=O)C)C=C1
MolPort-044-811-032 0.66 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCN1CCCC1=O
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MolPort-046-424-042 0.66 COc1ccc(CCNC(=O)C2Cc3cc(NC(C)=O)ccc3N3C[C@H]4C[C@@H](C23)c2cccc(=O)n2C4)cc1
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MCULE-5225986543 0.66 C12OC=C(C(=O)C1=CC=C1OC(CC(C3=CC=CC=C3)C=21)=O)C1=CC=C(C=C1)O
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MCULE-5293577262 0.66 C1(=O)C(C2C=CC(=CC=2)OC)=COC2C=C(OC)C=C(OC)C1=2
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MolPort-039-195-253 0.66 COCCn1ccc2c(OCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cccc12
MCULE-4169822091 0.66 C1(C2C=CC(=CC=2)OC(C)C)=COC2=C(C=CC(O)=C2)C1=O
MolPort-002-511-312 0.66 CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2cccs2)C1=O
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MCULE-7455668871 0.66 C1(C2C=CC(=CC=2)Cl)=COC2=C(C=C(C(OC)=C2)CC)C1=O
MolPort-001-743-493 0.66 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccnc3)c(=O)n1C2
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MCULE-7668384501 0.66 C1(=O)C2C=C(CC)C(=CC=2OC(C)=C1C1=CC=C(C=C1)OC)OC
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MCULE-9548512512 0.66 CCC1=C(OC)C=C2C(C(C(C3=CC=C(F)C=C3)=CO2)=O)=C1
MolPort-002-517-684 0.66 OC(=O)c1cccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MCULE-9357449000 0.66 CCCCC1=C(OC(C(OCC)=O)C)C=C2C(C(C(C3OC4=C(C=CC=C4)C=3)=CO2)=O)=C1
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MolPort-001-743-259 0.66 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc4ccccc4c3)c(=O)n1C2
MCULE-4640232651 0.66 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(OC(CCC3=CC=CC=C3)=O)C=2)C1=O
MolPort-027-718-745 0.66 OC(=O)[C@@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccccc1
MCULE-8386777819 0.66 C12C[C@H](C(O)(C)C)OC=1C(O)=C1OC(=O)C=CC1=C2
MolPort-046-597-007 0.66 Cc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-3430002549 0.66 C1(=O)C(C2=CC=C(C=C2)OC)=COC2=CC(OC(C)=O)=CC(OC(C)=O)=C12
MolPort-002-508-831 0.66 COc1cc(CC2(CN3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)cc(OC)c1OC
MCULE-6893919239 0.66 C1(C2C=CC=CC=2)=COC2C(=CC=C(C=2)OC(C)C(OC)=O)C1=O
MolPort-002-741-882 0.66 NS(=O)(=O)c1ccc(NC(=S)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MCULE-8953199022 0.66 C1(=O)OC2C=C(C=CC=2C=C1C1C=CC=CC=1)OCC(C1=CC=CC=C1)=O
MolPort-019-619-362 0.66 O=C(CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)NCC(c1ccccc1)c1ccccc1
MCULE-1668736662 0.66 C1(C2=CC=C3C(OCCCO3)=C2)=COC2C(=CC(=C(OCC3C=CC(=CC=3)OC)C=2)CCC)C1=O
MolPort-008-366-520 0.66 Fc1ccc(cc1)-c1n[nH]cc1CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-9022340447 0.66 C12C[C@@H](C(O)(C)C)OC=1C(O)=C1OC(=O)C=CC1=C2
MolPort-001-743-252 0.66 COCCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc4ccccc4c3)c(=O)n1C2
MCULE-5225630332 0.66 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(OCC(OC)=O)C=2)C1=O
MolPort-039-347-097 0.66 COc1ccc2[nH]c(cc2c1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-6721455766 0.66 C1(C2=CC=C(C=C2)Br)=COC2C(=CC=C(OCC(=O)C3C=CC(=CC=3)Cl)C=2)C1=O
MolPort-045-925-427 0.66 O=C(CCc1n[nH]c2CCCCc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-9760238163 0.66 C1(C2C=CC=CC=2)=COC2C(=CC=C(OCC(=O)OC(C)(C)C)C=2)C1=O
MolPort-007-922-772 0.66 CCC1CCCCN1C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(cc2)C(C)(C)C)c1
MCULE-1145585712 0.66 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=CC=3OCCC3C=CC4=C(CCO4)C=3)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-005-946-289 0.66 CC(=O)Nc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)C3CCCCC3)Cn2c1=O
MCULE-5337537319 0.66 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(OCC(=O)C3C=CC(=CC=3)Br)C=2)C1=O
MolPort-030-047-978 0.66 Cc1cccc(=O)n1CCC(=O)N1CC(C1)c1ccccn1
MCULE-2474862424 0.66 C1(C2C=CC=CC=2)=COC2C(=CC=C(OCC(OC(C)C)=O)C=2)C1=O
MolPort-046-140-830 0.66 O=C(CCn1ccccc1=O)N1CCC[C@@H]1CCc1ccccn1
MCULE-9077461969 0.66 Br.C1(C2=CC=C(C=C2)OC)=COC2=C(C=CC(=C2)OC(=O)C(N)CC2C=CC=CC=2)C1=O
MolPort-001-743-726 0.66 O=c1c(ccc2[C@@H]3C[C@@H](CN(Cc4cccc(c4)C#N)C3)Cn12)-c1cccnc1
MCULE-6104604631 0.66 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OC/C=C(\C)/C)C=2)CC)C1=O
MolPort-001-744-006 0.66 FC(F)(F)Oc1ccc(cc1)-c1ccc(=O)n2C[C@@H]3CNC[C@@H](C3)c12
MCULE-5852288217 0.66 C1(C2=CC=C(C=C2)OC)=COC2=C(C=CC(=C2)OC(=O)C(N)CC2C=CC=CC=2)C1=O
MolPort-046-424-378 0.66 COc1ccc2cc([nH]c2c1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-1301394352 0.66 C1(C2=CC=C3C(OCCCO3)=C2)=COC2C(=CC(=C(OC(C)C(OC)=O)C=2)CC)C1=O
MolPort-035-873-793 0.66 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1n[nH]c2ccccc12
MolPort-046-597-196 0.66 O=c1cccc2[C@H]3C[C@H](CN(Cc4nnnn4-c4ccccc4)C3)Cn12
MolPort-042-671-928 0.66 O=C(COc1ccc2OCOc2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-193-999 0.66 O=C(NC1CCS(=O)(=O)C1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-001-743-300 0.66 Clc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)C3CC3)Cn2c1=O
MolPort-029-886-346 0.66 COc1ccccc1CCN1C(=O)N[C@@H](CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MolPort-027-717-982 0.66 CN(Cc1ccccc1)Cc1c(O)c(=O)cc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n1C
MolPort-005-977-350 0.66 Cc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-035-873-829 0.66 COCCn1cc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-046-424-432 0.66 OC(=O)C(NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccccc1
MolPort-002-514-432 0.66 O=C(NC(Cc1ccccc1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)OCc1ccccc1
MolPort-039-194-115 0.66 NS(=O)(=O)c1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-044-466-156 0.66 O=C(NCc1cccc(c1)-n1ccnc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-007-922-568 0.66 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)NCCc1ccccc1
MolPort-044-431-181 0.66 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccn2nnnc2c1
MolPort-007-920-873 0.66 CC1CCCN(C1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O
MolPort-002-522-149 0.66 O=c1cccc2[C@H]3C[C@H](CN(C3)c3ncnc4c3[nH]c3ccccc43)Cn12
MolPort-007-923-181 0.66 Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCN(CC1)c1cccc(Cl)c1
MolPort-007-920-839 0.66 CN(Cc1ccccc1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O
MolPort-028-856-924 0.66 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)NCc1ccccc1
MolPort-046-768-544 0.66 Nc1nc(N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2nc[nH]c2n1
MolPort-007-922-563 0.66 CC1CCN(CC1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O
MolPort-007-922-930 0.66 Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCN(CC1)c1ccccc1Cl
MolPort-039-347-784 0.66 CC(C)(C)c1cc([nH]n1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-194-073 0.66 O=C(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C1c2ccccc2Oc2ccccc12
MolPort-007-920-879 0.66 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCCCC1
MolPort-007-920-847 0.66 CC1CCCCN1C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O
MolPort-046-596-460 0.66 O=c1cccc2[C@@H]3C[C@H](CN(C3)c3ncnc4c3[nH]c3ccccc43)Cn12
MolPort-007-920-855 0.66 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCC(Cc2ccccc2)CC1
MolPort-002-516-654 0.66 O=C(NC(=S)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)C1c2ccccc2Oc2ccccc12
MolPort-007-981-047 0.66 OC(=O)c1cc(c(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O)[N+]([O-])=O
MolPort-046-068-156 0.66 COc1ccc(CCNC(=O)[C@@H]2Cc3cc(NC(C)=O)ccc3N3C[C@H]4C[C@@H]([C@H]23)c2cccc(=O)n2C4)cc1
MolPort-002-514-711 0.66 CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccco2)C1=O
MolPort-044-432-068 0.66 CC(C)c1cc([nH]n1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-029-885-123 0.66 COc1ccc2[nH]c(cc2c1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-744-472 0.66 CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)Nc3ccccc3)c(=O)n1C2
MolPort-000-754-809 0.66 [Cl-].Cn1c2ncn(CC(O)C[NH+]3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c(=O)n(C)c1=O
MolPort-044-431-287 0.66 OC(=O)C(NC(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccccc1
MolPort-035-700-562 0.66 CC(C)c1cc([nH]n1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-005-909-660 0.66 COc1ccc2cc([nH]c2c1)C(=O)N1C[C@H]2CC(C1)c1cccc(=O)n1C2
MolPort-039-193-936 0.66 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccc2OCOc2c1
MolPort-002-513-639 0.66 O=c1cccc2[C@@H]3C[C@@H](CN(C3)C3=Nc4cccc5cccc3c45)Cn12
MolPort-046-596-440 0.66 O=c1cccc2[C@@H]3C[C@H](CN(C3)C3=Nc4cccc5cccc3c45)Cn12
MolPort-030-042-370 0.66 OC(=O)c1cccc(NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c1
MolPort-004-973-561 0.66 Nc1cccc(c1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-532-131 0.66 COc1ccc2cc([nH]c2c1)C(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-030-042-379 0.66 OC(=O)C(NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2)c1ccccc1
MolPort-000-856-855 0.66 O=C(CCCc1cn(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c2ccccc12)N1CCCCC1
MolPort-002-522-240 0.66 OC1(CC#CCN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)c2ccccc2-c2ccccc12
MolPort-002-513-846 0.66 O=C(NC1CCS(=O)(=O)C1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-595-449 0.66 O=C(N1CC2CC(C1)c1cccc(=O)n1C2)c1ccn2nnnc2c1
MolPort-005-910-201 0.66 Cc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MolPort-009-705-715 0.66 Cc1cc2oc(=O)cc(CN3CC4CC(C3)c3cccc(=O)n3C4)c2cc1O
MolPort-002-167-536 0.66 COc1cc(cc(CN2CC3CC(C2)c2cccc(=O)n2C3)c1O)[N+]([O-])=O
MolPort-005-972-050 0.66 CNC(=O)C(=O)Nc1ccccc1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-009-745-145 0.66 O=C(N1CC2CC(C1)c1cccc(=O)n1C2)c1ccc2OCOc2c1
MolPort-002-519-503 0.66 C[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccccc1F
MolPort-039-194-082 0.66 CCOC(=O)c1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-046-424-042 0.66 COc1ccc(CCNC(=O)C2Cc3cc(NC(C)=O)ccc3N3C[C@H]4C[C@@H](C23)c2cccc(=O)n2C4)cc1
MolPort-039-035-486 0.66 C(Cc1ccccn1)C1CCCCN1CCc1ccccn1
MolPort-039-194-162 0.66 O=C(CCCc1cn(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12)N1CCCCCC1
MolPort-039-194-108 0.66 COC(=O)CC(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(=O)OC
MolPort-042-576-253 0.66 O=C(NCCc1cccc(=O)[nH]1)[C@@H]1CCCN2CCCC[C@H]12
MolPort-044-566-083 0.66 CCOc1cc(CC2(CN3CC4CC(C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)ccc1O
MolPort-044-230-865 0.66 CC(C)OCc1cccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MolPort-044-430-588 0.66 C[C@@H](C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cnc2ccccc2c1=O
MolPort-046-598-075 0.66 Cn1c2ncn(CC(O)C[NH+]3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c(=O)n(C)c1=O
MolPort-039-347-099 0.66 CC(C(=O)N1CC2CC(C1)c1cccc(=O)n1C2)n1cnc2ccccc2c1=O
MolPort-027-718-651 0.66 Cc1cccc2nc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc(=O)n12
MolPort-039-193-904 0.66 COc1cccc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)c1OC
MolPort-038-428-782 0.66 CC(C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)n1cnc2ccccc2c1=O
MolPort-044-180-680 0.66 [O-][N+](=O)c1ccc2C3C[C@@H](CN(C3)C(=O)CCn3ccc4ccccc34)Cn2c1=O
MolPort-046-768-584 0.66 Cl.Clc1ccc(s1)C(=O)CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-700-935 0.66 COc1cn(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(C)cc1=O
MolPort-027-846-252 0.66 Oc1nc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)nc2cc(Cl)ccc12
MolPort-035-873-584 0.66 COCCn1cc(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-046-597-800 0.66 [O-][N+](=O)c1ccc2[C@H]3C[C@@H](CN(C3)C(=O)CCn3ccc4ccccc34)Cn2c1=O
MolPort-046-068-156 0.66 COc1ccc(CCNC(=O)[C@@H]2Cc3cc(NC(C)=O)ccc3N3C[C@H]4C[C@@H]([C@H]23)c2cccc(=O)n2C4)cc1
MolPort-044-811-032 0.66 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCN1CCCC1=O
MolPort-028-856-924 0.66 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)NCc1ccccc1
MolPort-044-431-286 0.66 OC(=O)c1cccc(NC(=O)N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MolPort-044-431-287 0.66 OC(=O)C(NC(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccccc1
MolPort-046-424-378 0.66 COc1ccc2cc([nH]c2c1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-597-007 0.66 Cc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-038-429-944 0.66 CC(C)c1cc(n[nH]1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-424-432 0.66 OC(=O)C(NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccccc1
MolPort-030-042-370 0.66 OC(=O)c1cccc(NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c1
MolPort-044-431-424 0.66 OC(=O)[C@H](NC(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccccc1
MolPort-039-193-948 0.66 CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2cccs2)C1=O
MolPort-044-431-181 0.66 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccn2nnnc2c1
MolPort-046-596-460 0.66 O=c1cccc2[C@@H]3C[C@H](CN(C3)c3ncnc4c3[nH]c3ccccc43)Cn12
MolPort-035-873-793 0.66 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1n[nH]c2ccccc12
MolPort-039-193-999 0.66 O=C(NC1CCS(=O)(=O)C1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-194-003 0.66 COc1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(OC)c1
MolPort-039-193-936 0.66 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccc2OCOc2c1
MolPort-039-347-097 0.66 COc1ccc2[nH]c(cc2c1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-029-885-123 0.66 COc1ccc2[nH]c(cc2c1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-768-544 0.66 Nc1nc(N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2nc[nH]c2n1
MolPort-039-194-073 0.66 O=C(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C1c2ccccc2Oc2ccccc12
MolPort-042-645-052 0.66 [O-][N+](=O)c1ccc2C3CC(CN(C3)C(=O)CCn3ccc4ccccc34)Cn2c1=O
MolPort-044-543-350 0.66 Cc1cc(C)c2oc(=O)cc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-035-873-829 0.66 COCCn1cc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-027-564-379 0.66 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCC(Cc2ccccc2)CC1
MolPort-046-598-223 0.66 Nc1ccc(cc1)S(=O)(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-455-664 0.66 O=c1cccc2[C@@H]3C[C@@H](CN(Cc4cn(CC5CC5)nn4)C3)Cn12
MolPort-027-718-056 0.66 Oc1ccc2c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc(=O)oc2c1
MolPort-027-564-005 0.66 COC(=O)c1ccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-044-632-846 0.66 O=C(NCCOc1ccc(cc1)C#N)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-194-005 0.66 COc1ccc(CNC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1OC
MolPort-035-873-700 0.66 COCCn1cc(CCCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-027-846-058 0.66 Cc1ccc(cc1)S(=O)(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-194-094 0.66 Fc1ccc(cc1F)C(=O)NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-193-978 0.66 CCOc1ccccc1CC1(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)C(=O)N(C)C(=S)N(C)C1=O
MolPort-046-768-588 0.66 Cl.COC(=O)c1ccc2c(c1)nc(CN1C[C@@H]3C[C@@H](C1)c1cccc(=O)n1C3)[nH]c2=O
MolPort-039-195-253 0.66 COCCn1ccc2c(OCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cccc12
MolPort-046-065-881 0.66 Nc1ccc(cc1)S(=O)(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-027-718-155 0.66 Cc1ccn2c(c1)nc(CN1C[C@H]3C[C@@H](C1)c1cccc(=O)n1C3)cc2=O
MolPort-044-811-086 0.66 CN1CCN(CC1)C(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MolPort-044-563-939 0.66 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCc1ccncc1
MolPort-044-563-942 0.66 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCC=C
MolPort-044-543-776 0.66 Oc1ccc(CCNC(=O)[C@@H]2Cc3cc(ccc3N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@@H]23)[N+]([O-])=O)cc1
MolPort-029-885-545 0.66 COc1ccc(CCN2C(=O)N[C@@H](CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)cc1
MolPort-044-180-103 0.66 O=C(CC(c1ccsc1)n1cccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-514-005 0.65 Cc1cc(co1)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-543-684 0.65 O=C(COc1ccc2c3ccnc4c3n(c2c1)c(=O)c1ccccc41)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-019-560-914 0.65 O=C(CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)c1ccc(cc1)-c1ccccc1
MolPort-044-564-087 0.65 O=C(COc1ccc2OCOc2c1)NCCN1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-525-576 0.65 COc1ccc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)OC(C)(C)OC2=O)cc1
MolPort-019-560-886 0.65 Fc1ccc(cc1)C(=O)CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-194-102 0.65 COc1ccc2[nH]c(C)c(C(=O)CN3CC4C[C@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-001-743-244 0.65 O=C(N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc4ccccc4c3)c(=O)n1C2)c1ccccc1
MolPort-007-568-831 0.65 Fc1ccc(cc1)S(=O)(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-035-873-842 0.65 O=C(Cn1c(=O)[nH]c2ccccc2c1=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-001-743-685 0.65 Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(Cc4cccc(c4)C#N)C3)Cn2c1=O
MolPort-027-718-712 0.65 Cl.O=c1cccc2[C@H]3C[C@H](CN(Cc4nnnn4-c4ccccc4)C3)Cn12
MolPort-046-597-510 0.65 Cn1nc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2c1=O
MolPort-001-743-453 0.65 CSc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)C(C)(C)C)Cn2c1=O
MolPort-027-718-719 0.65 Cn1c(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCC(CC1)c1ccccc1
MolPort-019-558-503 0.65 Clc1ccc(cc1)C(=O)CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-001-743-720 0.65 COc1ccc(CN2C[C@@H]3C[C@H](C2)c2ccc(-c4cccnc4)c(=O)n2C3)cc1
MolPort-044-478-956 0.65 O=C(Nc1ccc(cc1)-n1cccn1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-511-636 0.65 CCOc1ccc(CC2(CN3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(CC=C)C2=O)cc1
MolPort-039-194-008 0.65 Cc1cc(co1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-042-671-884 0.65 O=C(Cn1c(=O)[nH]c2ccccc2c1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-005-909-821 0.65 O=C(CCCc1cn(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c2ccccc12)N1CCCC1
MolPort-044-431-293 0.65 CCOC(=O)c1ccc(NC(=O)N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-003-055-971 0.65 CCOC(=O)c1ccc(NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-044-467-029 0.65 Cc1cscc1CNC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-001-744-282 0.65 O=c1ccc(-c2cncnc2)c2[C@@H]3C[C@@H](CN(Cc4ccccc4)C3)Cn12
MolPort-046-597-077 0.65 O=C(CCCc1cn(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)c2ccccc12)N1CCCC1
MolPort-001-744-373 0.65 COc1ccc(CN2C[C@@H]3C[C@H](C2)c2c(ccc(=O)n2C3)-c2ccccc2)cc1
MolPort-027-718-526 0.65 COc1cc2nc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)[nH]c(=O)c2cc1OC
MolPort-046-596-760 0.65 COc1ccc2[nH]c(C)c(C(=O)CN3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-044-180-184 0.65 O=C(Cn1c(=O)[nH]c2ccccc2c1=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-181-231 0.65 COc1ccc2[nH]c(cc2c1)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-179-237 0.65 COCCn1cc(CC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-044-564-820 0.65 CCOC(=O)c1ccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-045-936-435 0.65 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccc(CN2CCCC2)o1
MolPort-002-518-896 0.65 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1cccc(C)c1C
MolPort-001-743-016 0.65 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(CCCc4ccccc4)C3)Cn2c1=O)c1ccncc1
MolPort-019-560-884 0.65 CC(=O)Nc1ccc(NC(=O)CSC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-002-518-666 0.65 Fc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-001-745-139 0.65 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(NC(=O)NC3CCCCC3)ccc(=O)n1C2
MolPort-001-745-154 0.65 CSCC(=O)Nc1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C3CCN(CC3)C(C)=O)c12
MolPort-001-744-082 0.65 C\C=C\c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)c3ccccc3)c12
MolPort-001-744-296 0.65 COc1ccc(CN2C[C@@H]3C[C@H](C2)c2c(\C=C\C)ccc(=O)n2C3)cc1
MolPort-001-746-590 0.65 COc1ccc(cc1)S(=O)(=O)NC[C@H]1C[C@@H]2CC[N@]1C[C@@H]2CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-001-743-487 0.65 OC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccnc3)c(=O)n1C2
MolPort-002-517-523 0.65 C[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(F)c(F)c1
MolPort-000-767-655 0.65 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(cc1)[N+]([O-])=O
MolPort-035-873-724 0.65 Clc1ccc(nn1)N1CCC(CC1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-744-470 0.65 CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)NC3CCCCC3)c(=O)n1C2
MolPort-039-056-993 0.65 CC(C)c1ccc(cc1)N1C(=O)N[C@@H](CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MolPort-005-946-275 0.65 OC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc4ccccc4c3)c(=O)n1C2
MolPort-042-646-661 0.65 OC(=O)[C@@H]1Cc2cc(ccc2N2C[C@H]3C[C@H](Cn4c3cccc4=O)C12)[N+]([O-])=O
MolPort-002-513-848 0.65 COc1ccc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=S)N(C)C2=O)c(OC)c1
MolPort-007-920-852 0.65 CN(C1CCCCC1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O
MolPort-019-560-885 0.65 Brc1ccc(cc1)C(=O)CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-044-566-322 0.65 Oc1nc2ccccc2c(=O)n1CCC(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-016-597-470 0.65 CN(C)c1nc(C)c(C)c(n1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-007-922-761 0.65 CC(C)CNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(cc2)C(C)(C)C)c1
MolPort-007-922-962 0.65 CCC(C)NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(cc2)C(C)(C)C)c1
MolPort-007-920-860 0.65 CC(C)c1ccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(c2)[N+]([O-])=O)cc1
MolPort-007-922-820 0.65 Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCN(CC1)c1ccc(cc1)[N+]([O-])=O
MolPort-044-810-814 0.65 COCCCN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MolPort-007-922-608 0.65 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)NC1CCCCC1
MolPort-007-920-844 0.65 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCCCCC1
MolPort-007-920-826 0.65 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCCC1
MolPort-002-533-728 0.65 OC(=O)[C@H]1Cc2cc(ccc2N2C[C@H]3C[C@H](Cn4c3cccc4=O)[C@H]12)[N+]([O-])=O
MolPort-000-824-204 0.65 OC(=O)C1Cc2cc(ccc2N2CC3CC(Cn4c3cccc4=O)C12)[N+]([O-])=O
MolPort-044-724-736 0.65 OC(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MolPort-039-194-012 0.65 CCOC(=O)c1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-046-597-245 0.65 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCC(CC1)c1ccccc1
MolPort-044-181-136 0.65 CC(C)c1cc([nH]n1)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-019-560-945 0.65 CC(NC(=O)CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)c1ccccc1
MolPort-002-517-044 0.65 COc1ccc(OC)c(NC(=S)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MolPort-046-595-427 0.65 FC(F)(F)Oc1ccccc1NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-509-608 0.65 O=C(\C=C\c1ccco1)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-028-855-558 0.65 Clc1cccc2[nH]c(cc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-160-215 0.65 COc1cc(CN2CC3CC(C2)c2cccc(=O)n2C3)c(cc1OC)[N+]([O-])=O
MolPort-027-846-648 0.65 COc1cc2nc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)nc(O)c2cc1OC
MolPort-039-193-925 0.65 O=C(\C=C\c1ccco1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-001-743-274 0.65 CC(C)(C)C(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccc(c3)C(F)(F)F)c(=O)n1C2
MolPort-044-430-884 0.65 COc1ccc(cc1OC)C(NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(C)C
MolPort-002-511-846 0.65 O=C(CCn1c2ccccc2oc1=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-511-756 0.65 COc1ccc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(Cc3ccccc3)C2=O)cc1
MolPort-028-856-610 0.65 COc1ccc2n(C)c(cc2c1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-007-921-246 0.65 CCN(CC)c1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccccc1F
MolPort-001-743-578 0.65 O=C(C1CCCCC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccc(c3)C#N)c(=O)n1C2
MolPort-001-743-529 0.65 CN(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cncnc3)c(=O)n1C2
MolPort-046-598-060 0.65 CCCOc1ccc(cc1)C(=O)NC(=S)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MolPort-007-921-144 0.65 CCN(C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccncc2)c1)c1cccc(C)c1
MolPort-002-728-872 0.65 Clc1ccc(Nc2nc(nc(n2)N2CC3CC(C2)c2cccc(=O)n2C3)N2CCOCC2)cc1
MolPort-001-743-254 0.65 CSCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc4ccccc4c3)c(=O)n1C2
MolPort-003-055-972 0.65 Cc1ccc(cc1)S(=O)(=O)NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-722-292 0.65 COc1ccc(CCNc2nc(Cl)nc(n2)N2CC3CC(C2)c2cccc(=O)n2C3)cc1OC
MolPort-039-194-067 0.65 Clc1ccc(C(=O)NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(Cl)c1
MolPort-005-980-487 0.65 COC(=O)C(CCSC)NC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-044-179-785 0.65 FC(F)(F)Oc1cccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MolPort-015-136-961 0.65 CCOC(=O)Cc1ccc(NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-016-586-237 0.65 Clc1ccc2occ(CN3CC4CC(C3)c3cccc(=O)n3C4)c(=O)c2c1
MolPort-002-516-765 0.65 O=C(OCc1ccccc1)N1CCCC1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-194-940 0.65 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc(cc1)-n1cnc2ccccc2c1=O
MolPort-046-107-687 0.65 Oc1cccc2C(CCc12)NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-347-096 0.65 COc1ccc2n(C)c(cc2c1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-001-743-486 0.65 CSCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccnc3)c(=O)n1C2
MolPort-001-743-484 0.65 COCCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccnc3)c(=O)n1C2
MolPort-007-932-451 0.65 Cc1ccc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(O)=O)cc1C
MolPort-001-743-451 0.65 CSc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)C3CCCCC3)Cn2c1=O
MolPort-035-873-435 0.65 Cn1nc(CC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c2ccccc2c1=O
MolPort-039-194-044 0.65 Clc1ccc(CC2(CN3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C2=O)c2ccccc2)cc1
MolPort-002-518-795 0.65 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1cccc(Cl)c1
MolPort-002-518-791 0.65 CCC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1cccc(Cl)c1
MolPort-001-742-876 0.65 COCCC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)CC(C)(C)C)Cn2c1=O
MolPort-001-743-131 0.65 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O)c1ccccc1
MolPort-002-517-943 0.65 CC(=O)c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-001-744-352 0.65 OC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccccc1
MolPort-005-946-249 0.65 CC(C)(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)c3ccncc3)c(=O)n1C2
MolPort-002-518-499 0.65 Cc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(C)c1
MolPort-046-768-547 0.65 Cl.CS(=O)(=O)N1CCc2cc(ccc12)C(=O)CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-744-044 0.65 O=C(NC1CCCCC1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cccnc1
MolPort-001-745-143 0.65 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(NC(=O)c3ccccc3)ccc(=O)n1C2
MolPort-002-517-472 0.65 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(F)cc1F
MolPort-001-744-355 0.65 O=C(NC1CCCCC1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccccc1
MolPort-001-745-149 0.65 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(NC(=O)c3ccc4ccccc4c3)ccc(=O)n1C2
MolPort-039-106-844 0.65 CCN(CC(C)=C)c1nc(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)nc2ccccc12
MolPort-001-743-134 0.65 CC(C)(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)c3ccccc3)c(=O)n1C2
MolPort-002-515-219 0.65 Clc1ccc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C2=O)c2ccccc2)cc1
MolPort-001-746-584 0.65 O=C(NC[C@H]1C[C@@H]2CC[N@]1C[C@@H]2CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccc2OCOc2c1
MolPort-002-519-050 0.65 COc1ccc(NC(=O)[C@@H](NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(C)C)cc1
MolPort-007-922-570 0.65 [O-][N+](=O)c1cc(ccc1NCCc1ccccc1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-001-744-831 0.65 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)c3ccc(cc3)C#N)c(=O)n1C2
MolPort-035-874-055 0.65 O=C(C1CN(Cc2ccc3OCOc3c2)C(=O)C1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-001-743-548 0.65 O=C(Nc1ccccc1)N1C[C@@H]2C[C@H](C1)c1ccc(C3CCCCC3)c(=O)n1C2
MolPort-007-922-664 0.65 CCCCCNc1ccc(cc1[N+]([O-])=O)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-001-783-949 0.65 C1CNCC(C1)c1ccccn1
MolPort-019-591-701 0.65 O=C(CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)N(c1ccccc1)c1ccccc1
MolPort-029-886-527 0.65 COc1ccccc1CCN1C(=O)N[C@@H](CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MolPort-039-037-162 0.65 Cc1cc(NC(=O)CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)no1
MolPort-039-193-935 0.65 CC1(C)OC[C@H](NC(=O)CCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)[C@@H](O1)c1ccccc1
MolPort-001-743-117 0.65 Fc1ccc(cc1)C(=O)Nc1ccc2[C@H]3CNC[C@H](C3)Cn2c1=O
MolPort-007-923-124 0.65 CC(C)(C)c1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCC(Cc2ccccc2)CC1
MolPort-019-618-474 0.65 CC(SC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(NC(C)=O)cc1
MolPort-035-873-422 0.65 CC(C)c1ccc(cc1)N1C(=O)N[C@@H](CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MolPort-019-618-131 0.65 CCc1ccc(NC(=O)CSC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-007-922-625 0.65 CC1CCN(CC1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(cc2)C(C)(C)C)c1
MolPort-001-744-326 0.65 CC(=O)Nc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(Cc4ccccc4)C3)c12
MolPort-007-920-927 0.65 CC(=O)c1cccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3ccncc3)c2)c1
MolPort-044-431-363 0.65 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCc1nc2ccccc2[nH]1
MolPort-001-744-053 0.65 O=C(C1CCCCC1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cncnc1
MolPort-044-564-794 0.65 OC(=O)C1Cc2cc(ccc2N2C[C@H]3C[C@@H](C12)c1cccc(=O)n1C3)[N+]([O-])=O
MolPort-007-922-955 0.65 CN(Cc1ccccc1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(cc2)C(C)(C)C)c1
MolPort-001-743-540 0.65 COc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1ccc(C3CCCCC3)c(=O)n1C2
MolPort-002-517-382 0.65 O=C(NCCC1=CCCCC1)[C@H](Cc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-811-043 0.65 COc1ccc(CCNC(=O)[C@@H]2Cc3cc(ccc3N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@@H]23)[N+]([O-])=O)cc1
MolPort-001-743-222 0.65 COc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)C3CCCCC3)Cn2c1=O
MolPort-044-543-828 0.65 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCc1nc2ccccc2[nH]1
MolPort-009-759-234 0.65 CN(C)c1ccc(cc1)C(=O)Nc1ccc(nc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-810-695 0.65 COCCNC(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MolPort-000-844-183 0.65 O=C(Cc1cn(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12)N1CCCCCC1
MCULE-7582034490 0.65 C12C[C@H](C(O)(C)C)OC=1C=C1OC(=CC1=C2)C1C=C(O)C=C(O)C=1
MolPort-044-562-598 0.65 COc1ccc(CCNC(=O)[C@@H]2Cc3cc(ccc3N3C[C@@H]4C[C@H](Cn5c4cccc5=O)C23)[N+]([O-])=O)cc1
MolPort-001-743-163 0.65 O=C(Nc1ccccc1)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)C3CCCCC3)Cn2c1=O
MCULE-3525048376 0.65 C1(C2C=CC=CC=2)=COC2C(=CC=C(OCC(OCCC)=O)C=2)C1=O
MolPort-044-181-169 0.65 OC(=O)[C@@H]1Cc2cc(ccc2N2C[C@H]3C[C@@H]([C@H]12)c1cccc(=O)n1C3)[N+]([O-])=O
MolPort-044-810-697 0.65 OC12CCCCC1CN(CC2)C(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MCULE-4320890083 0.65 C1(OC)C=C2OC=C(C3C(O)=CC(O)=CC=3)C(=O)C2=C(O)C=1
MolPort-046-597-412 0.65 O=C(C1CN(Cc2ccc3OCOc3c2)C(=O)C1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-517-527 0.65 CCCCOc1ccc(NC(=O)CCNC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MCULE-8008208979 0.65 C1(C2C=CC=CC=2)=COC2C(=CC=C(C=2)OC(C)C(=O)OC(C)C)C1=O
MolPort-020-392-797 0.65 Cl.Cl.C1CNCC(C1)c1ccccn1
MolPort-046-178-791 0.65 Cc1cc(C)n(n1)-c1ccccc1CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-6114132196 0.65 C12C(O)=CC3=C(C(C4C=CC(=CC=4)OCC(C)=C)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-001-744-171 0.65 CC(=O)Nc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)C(C)(C)C)c12
MolPort-002-518-448 0.65 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccccc1Cl
MCULE-7908672705 0.65 C1(C2C=CC=CC=2)=COC2C(=CC=C(OCC(OCCCC)=O)C=2)C1=O
MolPort-019-558-413 0.65 CC(C)c1ccc(NC(=O)CSC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-002-517-637 0.65 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(F)c(F)c1
MCULE-5802274914 0.65 C1(C2C=CC=CC=2)=COC2C(=CC=C(C=2)OC(C)C(=O)OCC(C)C)C1=O
MolPort-001-745-162 0.65 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(NC(=O)NC3CCCCC3)ccc(=O)n1C2
MolPort-002-193-764 0.65 Fc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-6287854430 0.65 C12OC=C(C(=O)C1=CC=C(OC)C=2C(CC(OC)=O)C1C=CC(=CC=1OC)OC)C1=CC=C(C=C1)OC
MolPort-001-743-840 0.65 O=C(NC1CCCCC1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc2ccccc2c1
MolPort-039-193-870 0.65 OC(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MCULE-9759555374 0.65 C1(C2C=CC(=CC=2)Br)=COC2C(=CC=C(OCC(C)=C)C=2)C1=O
MolPort-002-518-535 0.65 CCOC(=O)c1ccc(NC(=O)CCNC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-035-873-724 0.65 Clc1ccc(nn1)N1CCC(CC1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-1171327701 0.65 C1(C2C=CC=CC=2)=COC2C(=CC=C(C=2)OC(C)C(=O)OC(C)CC)C1=O
MolPort-028-743-904 0.65 Cc1cccc(=O)n1CCC(=O)N1CCCC(C1)c1nccn1C
MolPort-027-846-648 0.65 COc1cc2nc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)nc(O)c2cc1OC
MCULE-4160726023 0.65 C1(C2C=CC=CC=2)=COC2C(=CC=C(C=2)OC(C)C(OCCCC)=O)C1=O
MolPort-001-744-359 0.65 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccccc1
MolPort-027-718-585 0.65 O=C(C1CN(C(=O)C1)c1n[nH]c2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-6394481654 0.65 C1(OC(=O)C)C=C2OC=C(C3C=CC(OC(=O)C)=CC=3)C(=O)C2=CC=1
MolPort-001-743-151 0.65 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)NC3CCCCC3)Cn2c1=O)C1CCCCC1
MolPort-039-194-022 0.65 Cc1ccc2[nH]c3c(ncnc3c2c1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-5351022964 0.65 COC1=CC=C(CCC(OC2=CC3=C(C(C(C4=CC=CC=C4)=C(O3)C)=O)C=C2)=O)C=C1
MolPort-001-745-161 0.65 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(NC(=O)Nc3ccccc3)ccc(=O)n1C2
MolPort-039-345-999 0.65 O=C(C1CN(C(=O)C1)c1n[nH]c2ccccc12)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-5665174988 0.65 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=C(O)C=3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-001-744-901 0.65 CSc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C3CCN(CC3)C(C)=O)c12
MolPort-044-181-169 0.65 OC(=O)[C@@H]1Cc2cc(ccc2N2C[C@H]3C[C@@H]([C@H]12)c1cccc(=O)n1C3)[N+]([O-])=O
MCULE-5063796395 0.65 C1(CO)OC(C(C(C1O)O)O)OC(C)(C)C1OC2C=C3OC(C)=CC(=O)C3=C(C=2C1)O
MolPort-001-744-277 0.65 O=c1ccc(-c2cccnc2)c2[C@@H]3C[C@@H](CN(Cc4cccc(c4)C#N)C3)Cn12
MolPort-044-543-828 0.65 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCc1nc2ccccc2[nH]1
MCULE-8243218005 0.65 C1(C2C=CC3=C(OCO3)C=2)=COC2=C(C=C(C(OC(C)C(OC)=O)=C2)CC)C1=O
MolPort-000-789-866 0.65 CN1C(=O)N(C)C(=O)C(CN2CC3CC(C2)c2cccc(=O)n2C3)(Cc2cn(Cc3ccccc3)c3ccccc23)C1=O
MolPort-044-562-598 0.65 COc1ccc(CCNC(=O)[C@@H]2Cc3cc(ccc3N3C[C@@H]4C[C@H](Cn5c4cccc5=O)C23)[N+]([O-])=O)cc1
MCULE-6084529238 0.65 C1(C2C=CC3=C(OCO3)C=2)=COC2=C(C=C(C(OC(C)=O)=C2)CCC)C1=O
MolPort-039-194-068 0.65 CCCOc1ccc(cc1)C(=O)NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-044-431-363 0.65 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCc1nc2ccccc2[nH]1
MCULE-4305952338 0.65 C1(=O)C(C2=CC=C(C=C2)OCC2C=CC(=CC=2)C)=COC2=CC(OCC3=CC=C(C=C3)C)=CC(OCC3=CC=C(C=C3)C)=C12
MolPort-000-801-854 0.65 Cn1nc(nc1N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)[N+]([O-])=O
MolPort-044-811-043 0.65 COc1ccc(CCNC(=O)[C@@H]2Cc3cc(ccc3N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@@H]23)[N+]([O-])=O)cc1
MCULE-4898409102 0.65 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=C(OC)C=3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-000-802-949 0.65 COc1cc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=S)N(C)C2=O)cc(OC)c1OC
MolPort-044-564-794 0.65 OC(=O)C1Cc2cc(ccc2N2C[C@H]3C[C@@H](C12)c1cccc(=O)n1C3)[N+]([O-])=O
MCULE-2670789313 0.65 C1(O)C(C/C=C(/C)\C)=C2OC=C(C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1CC(O)C(=C)C
MolPort-042-644-537 0.65 CC(C)C(NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCCc1c[nH]c2ccccc12
MolPort-044-810-695 0.65 COCCNC(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MCULE-6940819017 0.65 C12OC=C(C(=O)C1=CC=C(O)C=2C(C1=CC=C(C=C1)OCC(OC)=O)CC(OC)=O)C1=CC=C(C=C1)O
MolPort-009-705-714 0.65 Cc1cc2oc(=O)cc(CN3CC4CC(C3)c3cccc(=O)n3C4)c2cc1Cl
MolPort-020-392-797 0.65 Cl.Cl.C1CNCC(C1)c1ccccn1
MCULE-5138937043 0.65 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=C(OC(C)C)C=3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-035-699-821 0.65 CC(C)[C@H](NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCCc1c[nH]c2ccccc12
MolPort-035-874-055 0.65 O=C(C1CN(Cc2ccc3OCOc3c2)C(=O)C1)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-9099471232 0.65 C1(C2=CC=C3C(OCO3)=C2)=COC2C(=CC(=C(OC)C=2)CCC)C1=O
MolPort-002-533-075 0.65 CCOc1ccc(CC2(CN3CC4C[C@H](C3)c3cccc(=O)n3C4)C(=O)OC(C)(C)OC2=O)cc1
MolPort-046-597-412 0.65 O=C(C1CN(Cc2ccc3OCOc3c2)C(=O)C1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-6862152741 0.65 C1(C2C=CC=CC=2)=COC2C(=CC=C(OCC(OCC)OCC)C=2)C1=O
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MolPort-039-037-162 0.65 Cc1cc(NC(=O)CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)no1
MCULE-2627246144 0.65 C12C=C3C[C@H](O)C(C)(C)OC3=CC=1OC(=O)C=C2
MolPort-044-566-564 0.65 CC(C)c1cc(n[nH]1)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-028-743-904 0.65 Cc1cccc(=O)n1CCC(=O)N1CCCC(C1)c1nccn1C
MCULE-8508358387 0.65 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(OCCCC)C=2)C1=O
MolPort-046-454-449 0.65 CC(C)c1ncc(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)s1
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MCULE-1780520688 0.65 C1(C2C=CC=CC=2)=COC2C(=CC=C(OCC(OCC(C)C)=O)C=2)C1=O
MolPort-003-055-947 0.65 COc1ccc(OC)c(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)c1
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MCULE-4111405132 0.65 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=CC=3OC)OC)C=21)=O)C1C=CC=CC=1
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MolPort-044-566-564 0.65 CC(C)c1cc(n[nH]1)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-6081362741 0.65 C12C(OC)=CC(=C(C(CO)C(CO)O)C=1OC1=CC=CC(O)=C1C2=O)O
MolPort-039-346-301 0.65 Clc1cccc2[nH]c(cc12)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-044-180-318 0.65 FC(F)(F)Oc1ccccc1NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-2632408195 0.65 C12OC=C(C(=O)C1=CC=C1OC(CC(C3=CC=C(C=C3)O)C=21)=O)C1C=CC=CC=1
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MolPort-028-856-610 0.65 COc1ccc2n(C)c(cc2c1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-9681883319 0.65 C1(C2=CC=C3C(OCCO3)=C2)=C(C)OC2=C(C=C(C(OC(C)C)=C2)CC)C1=O
MolPort-039-193-998 0.65 O=C(CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)N1CCc2[nH]c3ccccc3c2C1
MolPort-044-181-136 0.65 CC(C)c1cc([nH]n1)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-4089044728 0.65 C12OC=C(C(=O)C1=CC=C(OC)C=2C(C1C=CC=CC=1)CC(OC)=O)C1=CC=C(C=C1)OC
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MCULE-2632181718 0.65 C1(C2C=CC=CC=2)=COC2C(=CC=C(OCC(OCC)=O)C=2)C1=O
MolPort-039-194-092 0.65 COc1ccc(OC)c(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MolPort-039-194-092 0.65 COc1ccc(OC)c(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MCULE-4310891952 0.65 C1(C2=CC=C(C=C2)OC)=COC2=C(C=CC(=C2)OC(C(C)N)=O)C1=O
MolPort-009-745-128 0.65 O=C(\C=C\c1ccco1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-044-430-884 0.65 COc1ccc(cc1OC)C(NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(C)C
MCULE-1915044303 0.65 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(O)C=3)O)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-004-975-456 0.65 FC(F)(F)C(=O)Nc1nnc(s1)N1CC2CC(C1)c1cccc(=O)n1C2
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MCULE-6764919720 0.65 C1(=O)C(C2C=CC(=CC=2)OC)=COC2=CC(O)=CC(O)=C12
MolPort-005-946-364 0.65 CN(C)Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(C3)C3CCN(CC3)C(C)=O)Cn2c1=O
MolPort-027-848-753 0.65 O=C(C1CN(C(=O)C1)c1[nH]nc2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-6609546002 0.65 C12C(O)=CC3=C(C(C4CCCCC4)CC(=O)O3)C=1OC=C(C1=CC=C(C=C1)Cl)C2=O
MolPort-027-718-612 0.65 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCC(C1)c1ccccc1
MolPort-042-564-064 0.65 O=C(CC[C@@H]1CCCN2CCCC[C@H]12)NCCc1cccc(=O)[nH]1
MCULE-9796366430 0.65 C1(=O)C(C2C=CC(=CC=2)OCC2C=CC=CC=2)=COC2C=C(OCC3=CC=CC=C3)C=C(OCC3C=CC=CC=3)C1=2
MolPort-001-744-193 0.65 COc1ccc(CN2C[C@@H]3C[C@H](C2)c2c(ccc(=O)n2C3)-c2ccc(OC)cc2)cc1
MolPort-042-572-619 0.65 CC1(C)CC(CC(=O)NCCc2cccc(=O)[nH]2)CC(C)(C)N1
MCULE-3850731547 0.65 C1(=O)C2=CC(CC)=C(C=C2OC(C)=C1C1C=CC(=CC=1)C1C=CC=CC=1)OC
MolPort-044-180-318 0.65 FC(F)(F)Oc1ccccc1NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-179-982 0.65 Cc1c(O)c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc2c3ccccc3c(=O)oc12
MCULE-8768278774 0.65 C1(C2=CC=CC=C2)=COC2C(=CC=C(OCC(OC)=O)C=2)C1=O
MolPort-046-595-441 0.65 COc1ccc(cc1OC)C(NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2)C(C)C
MolPort-039-194-020 0.65 COc1ccc(OC)c(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MCULE-2839316380 0.65 C1(C2C=CC=CC=2)=COC2C(=CC=C(C=2)OC(C)C(OCC)=O)C1=O
MolPort-005-910-751 0.65 COC(=O)[C@H](CCSC)NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-027-718-499 0.65 COc1ccc2oc(=O)cc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1
MCULE-1990622878 0.65 O1C(C)(C)[C@@H](O)CC2C=C3C=CC(=O)OC3=CC1=2
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MolPort-030-042-385 0.65 Cc1ccc(NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1C(O)=O
MCULE-9923015308 0.65 C1(=O)C2=CC(CC)=C(C=C2OC(C)=C1C1=CC=C(C=C1)C(C)C)OC
MolPort-004-975-500 0.65 Clc1ccc(C(=O)NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)c(Cl)c1
MolPort-028-856-638 0.65 Cc1noc(C)c1CCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-9776988658 0.65 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OCC(OCC=C)=O)C=2)CC)C1=O
MolPort-046-596-504 0.65 O=C(OCc1ccccc1)N1CCCC1C(=O)N1C[C@H]2CC(C1)c1cccc(=O)n1C2
MolPort-038-431-532 0.65 COc1ccc(CCNC(=O)C(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(C)C)cc1OC
MCULE-1495493639 0.65 COC1C=C2C(C(C(C3C=CC(O)=CC=3)=CO2)=O)=CC=1
MolPort-002-741-221 0.65 COC(=O)C(CCSC)NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-042-644-543 0.65 CC(C)C(NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCc1cccn1C
MCULE-3395510654 0.65 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC(=C(O)C=2)CCCCCC)C1=O
MolPort-004-931-166 0.65 Cc1cc2oc(=O)cc(CN3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2cc1Cl
MolPort-035-874-352 0.65 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cn(Cc2ccncc2)c(=O)c2ccccc12
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MolPort-039-345-999 0.65 O=C(C1CN(C(=O)C1)c1n[nH]c2ccccc12)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-042-664-620 0.65 Clc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-7419301729 0.65 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=C(O)C=3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
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MCULE-8706330433 0.65 C1(C2=CC=C3C(OCCO3)=C2)=C(C)OC2=C(C=C(C(OC(C)C)=C2)C(C)C)C1=O
MolPort-007-923-116 0.65 CC(C)(C)c1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCCCCC1
MolPort-035-699-963 0.65 CCn1c(C)cc(C)c(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1=O
MCULE-5177187950 0.65 C1(C2C=CC=CC=2)=COC2=C(C=CC(=C2)OC(CCCCCCCC)C(O)=O)C1=O
MolPort-005-969-697 0.65 [O-][N+](=O)c1cccc(c1)C(=O)NC(N1CC2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-046-597-771 0.65 COc1ccc(OC)c(NC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MCULE-5300327726 0.65 C1(C2=CC=C(C=C2)OC)=COC2=C(C=CC(=C2)OC(CCCCCCCC)C(OC)=O)C1=O
MolPort-001-745-155 0.65 CCCS(=O)(=O)Nc1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C3CCN(CC3)C(C)=O)c12
MolPort-035-700-364 0.65 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCc1cccn1C
MCULE-2712111088 0.65 C1(C2=CC=C(C=C2)OC)=COC2=C(C=CC(=C2)OC(CCCCCCCC)C(O)=O)C1=O
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MolPort-028-855-321 0.65 Cc1ccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1C(O)=O
MCULE-1545622657 0.65 C12OC=C(C(=O)C=1C=CC1OC(CC(C3C=CC=CC=3OCCC3C=CC(=CC=3)OC)C2=1)=O)C1C=CC(=CC=1)F
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MolPort-035-701-970 0.65 Cn1c(cc2ccc(Cl)cc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-2213616704 0.65 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC=C(OCCC4=CC=C5C(CCO5)=C4)C=3)C=21)=O)C1=CC=C(C=C1)O
MolPort-039-194-083 0.65 FC(F)(F)c1ccc(Cl)c(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MolPort-035-701-112 0.65 COc1ccc(CCNC(=O)[C@@H](NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(C)C)cc1OC
MCULE-7172242958 0.65 C12C=C(CC)C(OC(=O)C)=CC=1OC(C)=C(C1C=CC=CC=1C)C2=O
MolPort-001-744-046 0.65 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cccnc1
MolPort-027-828-972 0.65 CCCn1cc(C(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(C)n1
MCULE-2412962265 0.65 C1(C2C=CC(=CC=2)F)=COC2=C(C=C(C(OCC3C=CC=CC=3)=C2)CC)C1=O
MolPort-001-743-483 0.65 O=C(N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccnc3)c(=O)n1C2)c1ccncc1
MolPort-039-347-273 0.65 Cn1c(cc2ccc(Cl)cc12)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-5977631002 0.65 C1(=O)C2C=C(CC)C(=CC=2OC(C)=C1C1=CC=CC=C1)OC
MolPort-002-295-373 0.65 FC(F)(F)c1ccc(Cl)c(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)c1
MolPort-042-645-049 0.65 [O-][N+](=O)c1ccc2C3C[C@@H](CN(C3)C(=O)Cn3ccc4ccccc34)Cn2c1=O
MCULE-1683259206 0.65 C1(C2C=CC3=C(OCCO3)C=2)=C(CC)OC2=C(C=C(C(OC(C)C)=C2)CCC)C1=O
MolPort-028-856-638 0.65 Cc1noc(C)c1CCC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-595-471 0.65 [O-][N+](=O)c1ccc2C3CC(CN(C3)C(=O)Cn3ccc4ccccc34)Cn2c1=O
MCULE-9755315561 0.65 C1(C2C=CC3=C(OCCO3)C=2)=C(C)OC2=C(C=C(C(OCC(O)=O)=C2)CCC)C1=O
MolPort-001-743-836 0.65 COCCC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc2ccccc2c1
MolPort-039-194-062 0.65 Cc1ccccc1OCC(=O)NC(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MCULE-1981591632 0.65 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=CC=3OC)OC)C=21)=O)C1=CC=C(C=C1)O
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MolPort-039-194-642 0.65 CC(C)c1ccc2nc(cc(C(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1)-c1ccncc1
MCULE-6851108139 0.65 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(OCCBr)C=2)C1=O
MolPort-035-873-858 0.65 O=C(CCn1ccc2c(cnc3ccnn23)c1=O)N1CC2CC(C1)c1cccc(=O)n1C2
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MCULE-8461485723 0.65 C12OC=C(C(=O)C1=CC=C(O)C=2C(C1=CC=C(C=C1)OC(C)C)CC(OC)=O)C1=CC=C(C=C1)O
MolPort-002-507-528 0.65 OC(=O)c1ccccc1NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-194-083 0.65 FC(F)(F)c1ccc(Cl)c(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MCULE-8182143303 0.65 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=CC=3OCC(C)=C)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-001-743-681 0.65 COc1ccc(CN2C[C@@H]3C[C@H](C2)c2ccc(-c4ccccc4C)c(=O)n2C3)cc1
MolPort-046-595-392 0.65 Cc1c(O)c(CN2CC3CC(C2)c2cccc(=O)n2C3)cc2c3ccccc3c(=O)oc12
MCULE-7915107584 0.65 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC=CC=3OC)C=21)=O)C1=CC=C(C=C1)O
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MolPort-035-873-858 0.65 O=C(CCn1ccc2c(cnc3ccnn23)c1=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-1011711678 0.65 C1(C2=CC=C3C(OCCO3)=C2)=C(C)OC2=C(C=C(C(O)=C2)CCC)C1=O
MolPort-004-831-616 0.65 ClC(Cl)(Cl)C(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)NC(=O)c1ccccc1
MolPort-039-056-993 0.65 CC(C)c1ccc(cc1)N1C(=O)N[C@@H](CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MCULE-6644553060 0.65 C1(C2C=CC(=CC=2)Br)=COC2C(=CC=C(OCC)C=2)C1=O
MolPort-028-855-321 0.65 Cc1ccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1C(O)=O
MolPort-046-107-687 0.65 Oc1cccc2C(CCc12)NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-4210978398 0.65 C12C(O)=CC3=C(C(C4=CC=C(C=C4)Br)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-027-824-910 0.65 Oc1nc(ncc1C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C1CC1
MolPort-035-873-842 0.65 O=C(Cn1c(=O)[nH]c2ccccc2c1=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-8182921170 0.65 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=CC=3)OC(C)C)C=21)=O)C1=CC=C(C=C1)O
MolPort-046-597-771 0.65 COc1ccc(OC)c(NC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MolPort-044-431-293 0.65 CCOC(=O)c1ccc(NC(=O)N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MCULE-4418493145 0.65 C12OC=C(C(=O)C1=CC=C(OC)C=2C(C1=CC=C(C=C1)OCC(OC)=O)CC(OC)=O)C1=CC=C(C=C1)OC
MolPort-016-588-521 0.65 OC(=O)c1ccccc1NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-194-008 0.65 Cc1cc(co1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-2866676570 0.65 C12OC=C(C(=O)C1=CC=C1OC(CC(C3=CC=C(C=C3)C(C)C)C=21)=O)C1=CC=C(C=C1)O
MolPort-009-705-716 0.65 O=c1cc(CN2CC3CC(C2)c2cccc(=O)n2C3)c2cc3CCCc3cc2o1
MolPort-039-194-012 0.65 CCOC(=O)c1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MCULE-2991908377 0.65 C1(C2C=CC=CC=2)=COC2C(=CC=C(C=2)OC(=O)C2CC2)C1=O
MolPort-030-042-385 0.65 Cc1ccc(NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1C(O)=O
MolPort-035-873-435 0.65 Cn1nc(CC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c2ccccc2c1=O
MCULE-1817657261 0.65 C12C=C3CC(O)C(C)(C)OC3=CC=1OC(=O)C=C2
MolPort-035-699-963 0.65 CCn1c(C)cc(C)c(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1=O
MolPort-045-936-435 0.65 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccc(CN2CCCC2)o1
MCULE-3270200348 0.65 C1(C2C=CC3=C(OCO3)C=2)=COC2=C(C=C(C(OCC(O)=O)=C2)CC)C1=O
MolPort-035-700-364 0.65 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCc1cccn1C
MolPort-044-543-684 0.65 O=C(COc1ccc2c3ccnc4c3n(c2c1)c(=O)c1ccccc41)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-9883206898 0.65 C12C3OC(C)(C)CCC=3C3=C(C=CC(C)(C)O3)C=1OC=C(C1=CC=C(C=C1)O)C2=O
MolPort-039-194-062 0.65 Cc1ccccc1OCC(=O)NC(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-027-718-526 0.65 COc1cc2nc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)[nH]c(=O)c2cc1OC
MCULE-8292814850 0.65 C1(C2C=CC(=CC=2)OC)=COC2C(=CC=C(OC(C)=O)C=2)C1=O
MolPort-035-701-112 0.65 COc1ccc(CCNC(=O)[C@@H](NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(C)C)cc1OC
MolPort-039-194-102 0.65 COc1ccc2[nH]c(C)c(C(=O)CN3CC4C[C@H](C3)c3cccc(=O)n3C4)c2c1
MCULE-9594155012 0.65 C1(C2C=CC3=C(OCCO3)C=2)=C(C)OC2=C(C=C(C(OCC(OC)=O)=C2)CCC)C1=O
MolPort-035-874-352 0.65 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cn(Cc2ccncc2)c(=O)c2ccccc12
MolPort-044-179-237 0.65 COCCn1cc(CC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MCULE-7714502772 0.65 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OCCC4=CC=C5C(CCO5)=C4)C=3)OC)C=1OC=C(C1=CC=CC=C1)C2=O
MolPort-007-931-550 0.65 O=C(CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)N1CCC2(CC1)OCCO2
MolPort-044-566-322 0.65 Oc1nc2ccccc2c(=O)n1CCC(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-1945750988 0.65 C1(C2C=CC(=CC=2)OC)=COC2C(=CC=C(OC)C=2)C1=O
MolPort-046-595-392 0.65 Cc1c(O)c(CN2CC3CC(C2)c2cccc(=O)n2C3)cc2c3ccccc3c(=O)oc12
MolPort-044-478-956 0.65 O=C(Nc1ccc(cc1)-n1cccn1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-5079821919 0.65 C1(C2C=CC(=CC=2)OC)=COC2C(=CC3=C(OCCO3)C=2)C1=O
MolPort-027-828-972 0.65 CCCn1cc(C(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(C)n1
MolPort-042-671-884 0.65 O=C(Cn1c(=O)[nH]c2ccccc2c1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-6060120732 0.65 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=C4C=CC=CC=34)OC)C=21)=O)C1=CC=C(C=C1)O
MolPort-046-595-471 0.65 [O-][N+](=O)c1ccc2C3CC(CN(C3)C(=O)Cn3ccc4ccccc34)Cn2c1=O
MolPort-044-564-820 0.65 CCOC(=O)c1ccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MCULE-9083085570 0.65 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(OCC#N)C=2)C1=O
MolPort-001-743-251 0.65 O=C(N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc4ccccc4c3)c(=O)n1C2)c1ccncc1
MolPort-027-718-719 0.65 Cn1c(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCC(CC1)c1ccccc1
MCULE-3766183915 0.65 C12OC=C(C(=O)C1=CC=C(O)C=2C(CC(OC)=O)C1C=CC=CC=1OC(C)C)C1=CC=C(C=C1)O
MolPort-001-743-304 0.65 CN(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(Cl)cc3)c(=O)n1C2
MolPort-044-180-184 0.65 O=C(Cn1c(=O)[nH]c2ccccc2c1=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-8283971563 0.65 C12OC=C(C(=O)C1=CC=C1OC(CC(C3=CC=C(C=C3)OC)C=21)=O)C1=CC=C(C=C1)O
MolPort-001-743-843 0.65 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc2ccccc2c1
MolPort-044-467-029 0.65 Cc1cscc1CNC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-004-975-495 0.65 ClCC(=O)Nc1nnc(s1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-023-316-661 0.65 Cc1cn2cc(ccc2n1)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-007-921-140 0.65 CCN(C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(F)cc2)c1)c1cccc(C)c1
MolPort-027-718-712 0.65 Cl.O=c1cccc2[C@H]3C[C@H](CN(Cc4nnnn4-c4ccccc4)C3)Cn12
MolPort-007-921-296 0.65 CC(C)CNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccncc2)c1
MolPort-046-597-077 0.65 O=C(CCCc1cn(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)c2ccccc12)N1CCCC1
MolPort-002-525-180 0.65 FC(F)(F)c1ccc(Cl)c(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MolPort-044-181-231 0.65 COc1ccc2[nH]c(cc2c1)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-179-982 0.65 Cc1c(O)c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc2c3ccccc3c(=O)oc12
MolPort-044-724-736 0.65 OC(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MolPort-042-572-619 0.65 CC1(C)CC(CC(=O)NCCc2cccc(=O)[nH]2)CC(C)(C)N1
MolPort-044-810-814 0.65 COCCCN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MolPort-042-564-064 0.65 O=C(CC[C@@H]1CCCN2CCCC[C@H]12)NCCc1cccc(=O)[nH]1
MolPort-039-193-870 0.65 OC(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MolPort-027-848-753 0.65 O=C(C1CN(C(=O)C1)c1[nH]nc2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-042-646-661 0.65 OC(=O)[C@@H]1Cc2cc(ccc2N2C[C@H]3C[C@H](Cn4c3cccc4=O)C12)[N+]([O-])=O
MolPort-039-194-022 0.65 Cc1ccc2[nH]c3c(ncnc3c2c1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-347-096 0.65 COc1ccc2n(C)c(cc2c1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-001-743-271 0.65 FC(F)(F)c1cccc(c1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)C3CCCCC3)Cn2c1=O
MolPort-046-596-760 0.65 COc1ccc2[nH]c(C)c(C(=O)CN3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-002-742-782 0.65 COc1ccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1Cl
MolPort-046-597-245 0.65 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCC(CC1)c1ccccc1
MolPort-007-920-924 0.65 CC(=O)c1cccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3ccc(F)cc3)c2)c1
MolPort-046-597-510 0.65 Cn1nc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2c1=O
MolPort-001-743-856 0.65 Clc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)C3CCCCC3)c12
MolPort-039-194-067 0.65 Clc1ccc(C(=O)NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(Cl)c1
MolPort-002-514-270 0.65 Cc1ccc2[nH]c3c(ncnc3c2c1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-346-301 0.65 Clc1cccc2[nH]c(cc12)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-027-718-585 0.65 O=C(C1CN(C(=O)C1)c1n[nH]c2ccccc12)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-564-087 0.65 O=C(COc1ccc2OCOc2c1)NCCN1CC2CC(C1)c1cccc(=O)n1C2
MolPort-007-981-023 0.65 COc1ccc(cc1)C(=O)Nc1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)C#N
MolPort-046-595-427 0.65 FC(F)(F)Oc1ccccc1NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-519-508 0.65 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(Oc2ccccc2)cc1
MolPort-046-595-441 0.65 COc1ccc(cc1OC)C(NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2)C(C)C
MolPort-038-431-532 0.65 COc1ccc(CCNC(=O)C(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(C)C)cc1OC
MolPort-046-598-060 0.65 CCCOc1ccc(cc1)C(=O)NC(=S)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MolPort-002-514-232 0.65 COc1ccc(OC)c(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MolPort-039-193-925 0.65 O=C(\C=C\c1ccco1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-516-877 0.65 FC(F)(F)c1ccc(Cl)c(NC(=S)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MolPort-035-699-821 0.65 CC(C)[C@H](NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCCc1c[nH]c2ccccc12
MolPort-002-516-409 0.65 Fc1ccc(OCC(=O)NC(N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)C(Cl)(Cl)Cl)cc1
MolPort-039-194-940 0.65 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc(cc1)-n1cnc2ccccc2c1=O
MolPort-002-722-942 0.65 COc1nc(NCC2CCCO2)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-045-943-589 0.65 O=C(CN1CCOc2ccccc2C1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-519-301 0.65 OC(=O)c1ccccc1NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-042-644-537 0.65 CC(C)C(NC(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCCc1c[nH]c2ccccc12
MolPort-039-347-273 0.65 Cn1c(cc2ccc(Cl)cc12)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-046-597-458 0.65 O=C(CCn1ccc2c(cnc3ccnn23)c1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-042-664-620 0.65 Clc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-193-998 0.65 O=C(CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)N1CCc2[nH]c3ccccc3c2C1
MolPort-042-644-543 0.65 CC(C)C(NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCc1cccn1C
MolPort-039-194-068 0.65 CCCOc1ccc(cc1)C(=O)NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-516-435 0.65 [O-][N+](=O)c1cccc(c1)C(=O)NC(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-029-886-527 0.65 COc1ccccc1CCN1C(=O)N[C@@H](CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MolPort-002-516-326 0.65 Cc1ccccc1OCC(=O)NC(N1C[C@@H]2CC(C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-046-454-449 0.65 CC(C)c1ncc(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)s1
MolPort-035-701-970 0.65 Cn1c(cc2ccc(Cl)cc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-193-935 0.65 CC1(C)OC[C@H](NC(=O)CCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)[C@@H](O1)c1ccccc1
MolPort-002-516-112 0.65 ClC(Cl)(Cl)C(NC(=S)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)NC(=O)c1ccccc1
MolPort-039-194-044 0.65 Clc1ccc(CC2(CN3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C2=O)c2ccccc2)cc1
MolPort-042-645-049 0.65 [O-][N+](=O)c1ccc2C3C[C@@H](CN(C3)C(=O)Cn3ccc4ccccc34)Cn2c1=O
MolPort-046-178-791 0.65 Cc1cc(C)n(n1)-c1ccccc1CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-016-589-763 0.65 FC(F)(F)c1ccc(Cl)c(NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c1
MolPort-039-106-844 0.65 CCN(CC(C)=C)c1nc(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)nc2ccccc12
MolPort-002-512-210 0.65 O=C(N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)C1=COCCO1
MolPort-046-768-547 0.65 Cl.CS(=O)(=O)N1CCc2cc(ccc12)C(=O)CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-027-718-499 0.65 COc1ccc2oc(=O)cc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-044-810-697 0.65 OC12CCCCC1CN(CC2)C(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MolPort-039-194-642 0.65 CC(C)c1ccc2nc(cc(C(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1)-c1ccncc1
MolPort-035-873-422 0.65 CC(C)c1ccc(cc1)N1C(=O)N[C@@H](CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MolPort-039-194-155 0.65 CCOc1ccc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)OC(C)(C)OC2=O)cc1
MolPort-039-194-155 0.65 CCOc1ccc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)OC(C)(C)OC2=O)cc1
MolPort-007-922-673 0.65 CC(C)(C)c1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1cccc(c1)C(F)(F)F
MolPort-046-455-662 0.65 CCCc1nc(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cs1
MolPort-001-743-166 0.65 CC(C)(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)Nc3ccccc3)c(=O)n1C2
MolPort-023-316-661 0.65 Cc1cn2cc(ccc2n1)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-007-920-851 0.64 CCN(C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O)c1cccc(C)c1
MolPort-046-473-712 0.64 CC(C)(C)c1cnc(o1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-6752972703 0.64 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OCC3=CC=C(C=C3)F)C=2)CCC)C1=O
MolPort-007-920-868 0.64 CCN1CCN(CC1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O
MolPort-038-432-146 0.64 COc1ccc2n(CCNC(=O)C(NC(=O)N3CC4C[C@@H](C3)c3cccc(=O)n3C4)C(C)C)ccc2c1
MCULE-8786967249 0.64 C1(OC)C=C2OC=C(C3C(O)=CC(O)=CC=3)C(=O)C2=CC=1
MolPort-002-523-379 0.64 C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)C(CN4C[C@H]5C[C@H](C4)c4cccc(=O)n4C5)[C@H]3C=C12
MolPort-038-431-623 0.64 CC(C)Cc1cc(n[nH]1)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-2695962835 0.64 C1(C2=CC=C(C=C2)Cl)=COC2C(=CC=C(OCC(=O)C3C=CC(=CC=3)F)C=2)C1=O
MolPort-002-528-720 0.64 C[C@H]1CCC[C@]2(C)C[C@H]3OC(=O)C(CN4C[C@H]5C[C@@H](C4)c4cccc(=O)n4C5)[C@H]3C=C12
MCULE-5472198220 0.64 C12OC=C(C(=O)C1=CC=C1OC(CC(C3=CC=C(C=C3)OC)C=21)=O)C1C=CC=CC=1
MolPort-045-940-087 0.64 Cc1ccc(o1)-c1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-3127754902 0.64 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=C(OC)C=3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-001-743-838 0.64 CSCC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc2ccccc2c1
MCULE-3192928642 0.64 C1(C2=CC=CC=C2)=COC2C(=CC=C(OC(C)=O)C=2)C1=O
MolPort-039-347-480 0.64 CC(C)CCc1cc(n[nH]1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-1691659636 0.64 C1(O)C(CC(O)C(C)=C)=C2OC=C(C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1C/C=C(\C)/C
MolPort-002-299-132 0.64 COc1cc(OC)cc(c1)C(=O)NC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-1154437112 0.64 C12OC=C(C(=O)C1=CC=C1OC(CC(C3=CC=CC(O)=C3)C=21)=O)C1C=CC(=CC=1)O
MolPort-000-760-477 0.64 COc1ccc(\C=N\NC(=O)CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1CCN1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-5803675776 0.64 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(OCC(=O)C3C=CC(=CC=3)Cl)C=2)C1=O
MolPort-046-597-254 0.64 Clc1ccc2nc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc(=O)n2c1
MCULE-6769322828 0.64 O=C1C=CC2=CC3=C(C(=C2O1)C/C=C(\C)/C)OC(C(O)(C)C)C3
MolPort-006-370-924 0.64 Cc1cc(=O)[nH]c(NC(=N)N2CC3CC(C2)c2cccc(=O)n2C3)n1
MCULE-8402247669 0.64 O1C2C(C=C(C(C)(C)C=C)C1=O)=CC1C[C@@H](C(OC(C)=O)(C)C)OC=1C=2
MolPort-008-136-182 0.64 Cc1cc(=O)[nH]c(NC(=N)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n1
MCULE-2288561099 0.64 C1(C2=CC=C3C(OCCO3)=C2)=C(CC)OC2=C(C=C(C(OC(CC)=O)=C2)CCC)C1=O
MolPort-046-598-050 0.64 COc1cccc(OC)c1C(=O)NC(=S)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MCULE-9609769791 0.64 C1(=O)C2C=C(CC)C(=CC=2OC(C)=C1C1C=CC(=CC=1)F)OCC(O)=O
MolPort-007-931-609 0.64 Fc1cc(F)c(CNC(=O)CNC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)c(F)c1
MCULE-7652348522 0.64 C12OC=C(C(=O)C1=CC=C(O)C=2C(C1C=CC(=CC=1)OCCCCCCCC)CC(OC)=O)C1=CC=C(C=C1)O
MolPort-039-194-099 0.64 CCCCOC(=O)c1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MCULE-5723859917 0.64 C1(C2C=CC=CC=2Cl)=COC2C(=CC(=C(OC)C=2)CC)C1=O
MolPort-035-814-275 0.64 CC(C)C[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)N1CCN(C\C=C\c2ccccc2)CC1
MCULE-3130263677 0.64 C12C(O)=CC3=C(C(CC(=O)O3)C3C=C(OC)C=C(OC)C=3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-007-922-995 0.64 CCN(C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2cccc(c2)C(F)(F)F)c1)c1cccc(C)c1
MCULE-6009495971 0.64 C1(C2=CC=C3C(OCCO3)=C2)=C(C)OC2C(=CC(=C(OC)C=2)CC)C1=O
MolPort-001-743-379 0.64 Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O
MCULE-5771767832 0.64 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=C(OCCC4=CC=C5C(CCO5)=C4)C=3)OC)C=21)=O)C1=CC=C(C=C1)O
MolPort-007-921-057 0.64 CCC(C)NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(F)cc2)c1
MCULE-1755438579 0.64 C1(C2C=CC(=CC=2)OC)=COC2C(=CC=C(O)C=2C)C1=O
MolPort-000-788-939 0.64 CCc1ccc(cc1)N1C(=O)NC(=O)C(CN2CC3CC(C2)c2cccc(=O)n2C3)(Cc2ccc(Cl)cc2)C1=O
MCULE-6682765702 0.64 C12OC=C(C(=O)C1=CC=C(O)C=2C(CC(OC)=O)C1C=CC(=C2C=CC=CC=12)OC)C1=CC=C(C=C1)O
MolPort-001-743-557 0.64 Clc1ccc(\C=C\c2ccc3[C@@H]4C[C@@H](CN(C4)C(=O)C4CCCCC4)Cn3c2=O)cc1
MCULE-1784316155 0.64 C12C(CCC(O)(C)C)=C(O)C(O)=CC=1OC1C=C3OC(C)(C)CCC3=C(O)C=1C2=O
MolPort-035-700-711 0.64 O=C(C[C@@H]1NC(=O)N(CCc2c[nH]c3ccccc23)C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-3036292697 0.64 C1(C2=CC=C(C(OC)=C2)OC)=COC2C(=CC=C(OCCOC3=CC=C4C(OC=C(C5=CC=C(C(OC)=C5)OC)C4=O)=C3)C=2)C1=O
MolPort-002-517-161 0.64 CCCCOC(=O)c1ccc(NC(=S)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MCULE-4685391613 0.64 C12OC=C(C(=O)C1=CC=C1OC(CC(C3=CC=CC=C3OCC(OC)=O)C=21)=O)C1C=CC=CC=1
MolPort-027-718-666 0.64 COc1ccc2c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc(=O)oc2c1
MCULE-7316011561 0.64 C1(C2=CC=C(C=C2)OC)=C(C)OC2C(=CC=C(OCCOC3C=CC4=C(OC(=C(C5C=CC(=CC=5)OC)C4=O)C)C=3)C=2)C1=O
MolPort-046-120-695 0.64 CNC(=O)C(C)(C)CNC(CCCC=C)Cc1ccccn1
MCULE-5835907874 0.64 C12OC=C(C(=O)C1=CC=C(OC)C=2C(C1C=CC(=CC=1)OC)CC(OC)=O)C1=CC=C(C=C1)OC
MolPort-001-744-081 0.64 CCCS(=O)(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)C1CCCCC1
MCULE-5444572995 0.64 C12C(O)=CC3=C(C(CC(=O)O3)C3=COC4=C(C=CC=C4)C3=O)C=1OC=C(C1=CC=CC=C1)C2=O
MolPort-001-743-132 0.64 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O)C1CCCCC1
MCULE-6411043781 0.64 C1(C2=CC=C3C(OCCCO3)=C2)=COC2C(=CC(=C(OCC3C=CC(=CC=3)C)C=2)CC)C1=O
MolPort-019-556-077 0.64 Ic1ccc(NC(=O)CSC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MCULE-1257642164 0.64 C12OC=C(C(=O)C1=CC=C(OC)C=2C(CC(OC)=O)C1C=CC=CC=1OC)C1=CC=C(C=C1)OC
MolPort-001-743-390 0.64 Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)CCC(O)=O)Cn2c1=O
MCULE-8976633911 0.64 C1(C2=CC=CC=C2)=COC2C(=CC=C(OCCBr)C=2)C1=O
MolPort-019-561-014 0.64 Ic1ccccc1NC(=O)CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-9136713725 0.64 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC=C(OCC(=O)C3C=CC(=CC=3)Cl)C=2)C1=O
MolPort-001-743-010 0.64 Fc1ccc(cc1)C(=O)Nc1ccc2[C@@H]3C[C@@H](CN(CCCc4ccccc4)C3)Cn2c1=O
MCULE-4261720464 0.64 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(O)C=3)OC)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-002-522-080 0.64 O=C1N(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c2ccccc2C1=O
MCULE-7582844872 0.64 C1(C2=CC=C3C(OCCCO3)=C2)=COC2=C(C=CC(OCC)=C2C)C1=O
MolPort-001-744-011 0.64 CSc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)C3CCCCC3)c12
MCULE-6689839618 0.64 C12C(O)=CC3=C(C(C4=CC=C(C=C4)O)CC(=O)O3)C=1OC=C(C1=CC=C(C=C1)Cl)C2=O
MolPort-019-558-443 0.64 Cc1cccc(C)c1NC(=O)CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-9750496818 0.64 C12C(O)=CC3=C(C(CC(=O)O3)C3=COC4=C(C=CC=C4)C3=O)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-001-744-634 0.64 CN(C)CC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(Cc4ccccn4)C3)Cn2c1=O
MCULE-7258549973 0.64 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC=C(OC)C=3OCCC3C=CC4=C(CCO4)C=3)C=21)=O)C1=CC=C(C=C1)O
MolPort-002-518-566 0.64 FC(F)(F)c1cccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MCULE-8669963954 0.64 C12OC=C(C(=O)C1=CC=C1OC(CC(C3=CC=C(C=C3)OCCCCCCCC)C=21)=O)C1=CC=C(C=C1)O
MolPort-039-194-017 0.64 CCc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(Cl)cc2)C1=O
MCULE-9857884941 0.64 O=C1C=CC2=CC=C3OC(C(OC(=O)C)(C)C)CC3=C2O1
MolPort-044-563-938 0.64 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCC1CCOCC1
MCULE-6841656147 0.64 C1(C=C2OC=C(C(C2=C(OC)C=1)=O)C1C=CC(O)=CC=1O)O
MolPort-046-597-974 0.64 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H]([C@@H]3[C@@H](Cc2c1)C(=O)NCCc1c[nH]c2ccccc12)c1cccc(=O)n1C4
MCULE-7941842222 0.64 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC=C(OC)C=3OCCC3=CC=CC=C3)C=21)=O)C1=CC=C(C=C1)O
MolPort-028-856-944 0.64 CC(C)(C)c1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(Cl)cc1
MCULE-2468017560 0.64 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OCCC4=CC=C5C(CCO5)=C4)C=3)OC)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-001-743-804 0.64 COc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)C3CCCCC3)c12
MCULE-9235848338 0.64 COC1=CC=C(C2C(=O)C3=C(C=C(C=C3)OCC(C3=CC=C(Cl)C=C3)=O)OC=2C)C=C1
MolPort-007-923-114 0.64 CC(=O)c1cccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3cccc(c3)C(F)(F)F)c2)c1
MCULE-2969638202 0.64 C1(C2C=CC=CC=2)=COC2C(=CC=C(OCC(=O)OC3CCCCC3)C=2)C1=O
MolPort-039-194-077 0.64 COc1cccc(OC)c1C(=O)NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-1648282710 0.64 C1(C2=CC=CC=C2)=COC2C(=CC=C(OCC#N)C=2)C1=O
MolPort-001-745-166 0.64 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(NC(=O)Nc3ccc(C)cc3)ccc(=O)n1C2
MCULE-9203104348 0.64 C12OC=C(C(=O)C1=CC=C(O)C=2C(C1C=CC(=CC=1)OC)CC(OC)=O)C1=CC=C(C=C1)O
MolPort-046-482-373 0.64 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1cn2cccnc2n1
MCULE-3112463296 0.64 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC4=C(OCCO4)C=3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-035-701-785 0.64 Clc1ccc(CN2C(=O)N[C@@H](CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)cc1
MCULE-8384756312 0.64 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(OCC(=O)C3C=CC(=CC=3)F)C=2)C1=O
MolPort-000-775-660 0.64 COc1cc(CC2(CN3CC4CC(C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)cc(I)c1O
MCULE-1718391172 0.64 C12OC=C(C(=O)C1=CC=C(O)C=2C(CC(OC)=O)C1C=CC(=C(OC)C=1)OCCC1=CC=CC=C1)C1=CC=C(C=C1)O
MolPort-028-854-772 0.64 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCc2ccccc2C1
MCULE-7996977734 0.64 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OCC)C=3)O)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-027-718-488 0.64 Cl.Clc1ccc2nc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc(=O)n2c1
MCULE-4727843061 0.64 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)O)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-004-831-620 0.64 [O-][N+](=O)c1ccccc1C(=O)NC(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MCULE-1496283051 0.64 C1(C2=CC=C3C(OCCCO3)=C2)=C(C)OC2=C(C=C(C(OC)=C2)CCC)C1=O
MolPort-002-513-341 0.64 CN1C(=S)N(C)C(=O)C(CN2C[C@H]3CC(C2)c2cccc(=O)n2C3)(Cc2ccc3OCOc3c2)C1=O
MolPort-044-713-880 0.64 Cc1cccc(=O)n1CCC(=O)NC1C2CN3CC1(CN(C2)CC3)c1ccccc1
MolPort-001-744-943 0.64 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccc4ccccc4c3)Cn2c1=O)C1CCCCC1
MolPort-001-744-105 0.64 Clc1ccc(\C=C\c2ccc(=O)n3C[C@H]4C[C@H](CN(C4)C(=O)C4CCCCC4)c23)cc1
MolPort-007-931-038 0.64 CCc1ccc(NC(=O)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NC2CCCCCCC2)cc1
MolPort-002-519-437 0.64 Fc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1F
MolPort-001-744-239 0.64 Fc1ccccc1-c1ccc(=O)n2C[C@H]3C[C@H](CN(Cc4cccc(c4)C#N)C3)c12
MolPort-035-700-784 0.64 Fc1cccc(CN2C(=O)N[C@@H](CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)c1
MolPort-002-518-088 0.64 Clc1cccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MolPort-002-511-755 0.64 COc1ccc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C2=O)c2ccccc2)cc1
MolPort-019-560-977 0.64 Brc1ccc(NC(=O)CSC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-005-946-288 0.64 O=C(NC1CCCCC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cncnc3)c(=O)n1C2
MolPort-002-517-431 0.64 COc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-007-665-954 0.64 CCOC(=O)N1CCC(CC1)Nc1c(N2CC3CC(C2)c2cccc(=O)n2C3)c(=O)c1=O
MolPort-001-744-517 0.64 CC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccn3)Cn2c1=O
MolPort-044-811-094 0.64 Cn1c(CCCCCNC(=O)[C@@H]2Cc3cc(ccc3N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@@H]23)[N+]([O-])=O)nc2ccccc12
MolPort-001-744-462 0.64 CCCS(=O)(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(C)=O)Cn2c1=O
MolPort-038-431-616 0.64 CC(C)CCc1cc(n[nH]1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-042-644-548 0.64 CC(C)C(NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCCc1ccco1
MolPort-046-768-552 0.64 Cl.COc1cc2CCN(Cc2cc1OC)C(=O)CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-632-848 0.64 COc1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c2cccnc12
MolPort-035-701-174 0.64 CC(C)CCc1cc([nH]n1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-733-082 0.64 COc1cc(OC)cc(c1)C(=O)NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-536-595 0.64 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cc2ccccc2o1
MolPort-002-770-676 0.64 COc1cc(OC)cc(c1)C(=O)NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-001-743-650 0.64 FC(F)(F)c1cccc(c1)-c1ccc2[C@@H]3C[C@@H](CN(Cc4cccc(c4)C#N)C3)Cn2c1=O
MolPort-035-700-468 0.64 COc1ccc(CCN2C(=O)N[C@@H](CCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)cc1OC
MolPort-000-825-138 0.64 [O-][N+](=O)c1ccccc1C(=O)NC(N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-002-533-598 0.64 COC(=O)c1cccc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MolPort-039-194-159 0.64 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1cc2ccccc2o1
MolPort-035-701-544 0.64 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCCc1ccco1
MolPort-001-744-884 0.64 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)Nc3cccc(c3)C#N)c(=O)n1C2
MolPort-001-744-291 0.64 O=c1ccc(-c2cncnc2)c2[C@@H]3C[C@@H](CN(C3)C3CCOCC3)Cn12
MolPort-039-193-963 0.64 COc1ccc(\C=N\NC(=O)CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-046-423-846 0.64 Clc1ccc2c(c1)[nH]cc(C(=O)N1C[C@H]3C[C@@H](C1)c1cccc(=O)n1C3)c2=O
MolPort-001-744-348 0.64 O=C(N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccccc1)c1ccncc1
MolPort-004-975-626 0.64 O=C(N1CC2CC(C1)c1cccc(=O)n1C2)c1cc(=O)[nH]c(=O)[nH]1
MolPort-039-193-987 0.64 CN1C(=S)N(C)C(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc3OCOc3c2)C1=O
MolPort-035-874-094 0.64 COCCn1c(cc2ccccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-028-574-843 0.64 O=c1cccc2[C@H]3C[C@H](CN(C3)c3nnc(o3)C3CCC3)Cn12
MolPort-019-560-944 0.64 Cc1ccc(CNC(=O)CSC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-007-922-965 0.64 CCC(C)NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccccc2Br)c1
MolPort-008-326-680 0.64 Cc1cccc(CC2CCCCCN2)n1
MolPort-002-514-863 0.64 O=C1NC(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc3OCOc3c2)C(=O)N1
MolPort-005-910-216 0.64 Fc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MolPort-002-516-431 0.64 ClC(Cl)(Cl)C(NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)NC(=O)c1cccc2ccccc12
MolPort-001-743-773 0.64 Fc1ccc(CN2C[C@@H]3C[C@H](C2)c2ccc(-c4cccc(c4)C#N)c(=O)n2C3)cc1
MolPort-038-431-623 0.64 CC(C)Cc1cc(n[nH]1)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-511-610 0.64 CN1C(=O)N(C)C(=O)C(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(C)s2)C1=O
MolPort-046-424-523 0.64 Fc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-038-432-146 0.64 COc1ccc2n(CCNC(=O)C(NC(=O)N3CC4C[C@@H](C3)c3cccc(=O)n3C4)C(C)C)ccc2c1
MolPort-001-743-826 0.64 O=C(N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc2ccccc2c1)c1ccccc1
MolPort-001-744-260 0.64 CSc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(Cc4ccccc4)C3)c12
MolPort-044-431-901 0.64 CC(C)Cc1cc([nH]n1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-001-744-916 0.64 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(OC(F)(F)F)cc3)c(=O)n1C2
MolPort-005-974-036 0.64 Cc1ccc2[nH]cc(C(N3CC4CC(C3)c3cccc(=O)n3C4)C(O)=O)c2c1
MolPort-044-179-943 0.64 Oc1ccc2ccc(=O)oc2c1CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-193-927 0.64 COc1ccc(\C=C\C(=O)c2ccccc2)cc1CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-044-632-838 0.64 O=C(NCc1ccccc1OC1CCC1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-000-804-382 0.64 COc1ccc(Br)cc1CC1(CN2CC3CC(C2)c2cccc(=O)n2C3)C(=O)N(C)C(=O)N(C)C1=O
MolPort-002-511-627 0.64 COc1ccccc1CC1(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(=O)NC(=O)N(Cc2ccccc2)C1=O
MolPort-005-909-817 0.64 CN1CCN(CC1)C(=O)CCCc1cn(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-000-809-289 0.64 CCOc1ccc(CC2(CN3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(Cc3ccccc3)C2=O)cc1
MolPort-044-478-902 0.64 O=C(Nc1nccn1-c1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-044-565-121 0.64 CN1C(=O)N(C)C(=O)C(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2ccc(C)s2)C1=O
MolPort-002-770-296 0.64 Fc1ccc(\C=C\C(=O)NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-035-873-665 0.64 Cc1cc(C)n(CC2CC2)c(=O)c1C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-744-351 0.64 CSCC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccccc1
MolPort-008-382-465 0.64 Cc1n[nH]c(SCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n1
MolPort-044-566-718 0.64 Cc1noc(C)c1CCC(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-598-062 0.64 Brc1ccc(\C=C\C(=O)NC(=S)N2C[C@@H]3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-039-194-172 0.64 Cc1ccc2[nH]cc(C(N3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)C(O)=O)c2c1
MolPort-035-700-582 0.64 CC(C)Cc1cc([nH]n1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-631-570 0.64 [O-][N+](=O)c1cc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)ccc1F
MolPort-008-346-884 0.64 Cc1ccc2[nH]cc(C(N3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(O)=O)c2c1
MolPort-046-473-712 0.64 CC(C)(C)c1cnc(o1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-035-873-813 0.64 COc1ccc2n(CCNC(=O)[C@@H](NC(=O)N3CC4C[C@@H](C3)c3cccc(=O)n3C4)C(C)C)ccc2c1
MolPort-002-509-663 0.64 COc1ccc(\C=C\C(=O)c2ccccc2)cc1CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-168-190 0.64 O=C(CC1(CCOCC1)N1Cc2ccccc2C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-194-034 0.64 COc1ccc(Br)cc1CC1(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)C(=O)N(C)C(=O)N(C)C1=O
MolPort-044-564-868 0.64 Oc1ncc(C(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-035-377-462 0.64 CCCCc1nc(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(Cl)[nH]1
MolPort-000-757-749 0.64 [O-][N+](=O)c1cc(NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)ccc1F
MolPort-040-583-932 0.64 O=C(Nc1ccc2ccoc2c1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-508-727 0.64 CN1C(=O)N(C)C(=O)C(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2ccc3OCOc3c2)C1=O
MolPort-046-597-101 0.64 Fc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-000-808-940 0.64 CCOc1ccc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(Cc3ccccc3)C2=O)cc1
MolPort-039-194-030 0.64 COc1cc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)cc(I)c1O
MolPort-000-827-704 0.64 Fc1ccc(\C=C\C(=O)NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-040-818-486 0.64 NC1CCC(CC1)NCC1(CCC1)c1ccccn1
MolPort-002-519-028 0.64 CCOc1ccc(NC(=O)[C@@H](NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(C)C)cc1
MolPort-044-431-358 0.64 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCCc1nc2ccccc2[nH]1
MolPort-046-681-995 0.64 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H]([C@@H]3[C@@H](Cc2c1)C(=O)NCCCn1ccnc1)c1cccc(=O)n1C4
MolPort-044-810-889 0.64 COCCN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MolPort-046-424-700 0.64 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H](C3C(Cc2c1)C(=O)NCCCn1ccnc1)c1cccc(=O)n1C4
MolPort-042-598-339 0.64 CN1CCN(CC1)C(=O)CCN1CCCC(C1)c1ccccn1
MolPort-005-947-085 0.64 OC(=O)C[C@@H]1CCN(C[C@@H]1CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(OC(F)(F)F)cc1
MolPort-001-743-839 0.64 OC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc2ccccc2c1
MolPort-001-746-603 0.64 O=c1cccc2[C@@H]3C[C@@H](CN(C[C@H]4C[N@@]5CC[C@H]4C[C@@H]5CNC(=S)Nc4ccc(cc4)-n4cccn4)C3)Cn12
MolPort-002-518-870 0.64 Fc1ccccc1NC(=O)[C@H](Cc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-519-138 0.64 Fc1cccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MolPort-000-838-227 0.64 Brc1ccc(\C=C\C(=O)NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-001-744-826 0.64 Fc1ccc(CN2C[C@@H]3C[C@H](C2)c2ccc(NC(=O)c4ccccc4)c(=O)n2C3)cc1
MolPort-002-519-275 0.64 Cc1cccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1C
MolPort-001-743-392 0.64 Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)NC3CCCCC3)Cn2c1=O
MolPort-001-744-936 0.64 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccc4ccccc4c3)Cn2c1=O)c1ccccc1
MolPort-001-743-137 0.64 OC(=O)C(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)C3CCCCC3)c(=O)n1C2
MolPort-001-743-146 0.64 COCCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)C3CCCCC3)c(=O)n1C2
MolPort-001-743-025 0.64 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(C3)c3ncccn3)Cn2c1=O)C1CCCCC1
MolPort-029-943-162 0.64 O[C@H]1CC[C@@H](CCN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)O[C@@H]1C(=O)N1CCN(CC1)c1ccccc1
MolPort-001-744-168 0.64 CC(=O)Nc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)C3CCCCC3)c12
MolPort-044-544-041 0.64 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCCc1nc2ccccc2[nH]1
MolPort-044-478-807 0.64 Cn1cc(CNC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(n1)C(F)(F)F
MolPort-007-921-210 0.64 O=C(NC1CCN(Cc2ccccc2)CC1)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccncc2)c1
MolPort-002-516-760 0.64 Cc1nc(C#N)c(o1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-046-597-407 0.64 COc1ccc2n(CCNC(=O)[C@@H](NC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(C)C)ccc2c1
MolPort-020-226-742 0.64 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cccc2ccnn12
MolPort-001-743-475 0.64 O=C(N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccnc3)c(=O)n1C2)c1ccccc1
MolPort-044-431-999 0.64 Cc1cc(C)n(CC2CC2)c(=O)c1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-027-718-834 0.64 Cn1c(N)c(C(=O)CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(=O)n(C)c1=O
MolPort-001-743-226 0.64 COc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)Cc3ccccc3)Cn2c1=O
MolPort-005-156-524 0.64 CCCc1cc([nH]n1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-038-398-721 0.64 CCn1c(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)nnc1[C@@H]1C[C@H](N)C1
MolPort-002-518-231 0.64 COc1ccc(CNC(=O)[C@@H](NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(C)C)cc1
MolPort-029-885-406 0.64 Fc1cccc(CN2C(=O)N[C@@H](CCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)c1
MolPort-001-743-396 0.64 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccccc3C)c(=O)n1C2
MolPort-039-194-070 0.64 Brc1ccc(\C=C\C(=O)NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-002-726-251 0.64 COc1nc(Nc2ccc(Cl)cc2)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-019-890-259 0.64 Cn1ccnc1-c1ccc(nn1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-744-122 0.64 O=C(C1CCCCC1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cccc(c1)C#N
MolPort-007-922-833 0.64 Fc1ccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3ccccc3)c2)cc1F
MolPort-007-923-132 0.64 COC(=O)c1ccccc1NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(N)c1
MolPort-007-923-103 0.64 CC(=O)c1cccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3ccccc3Br)c2)c1
MolPort-002-244-099 0.64 CCOc1nc(NCCC2=CCCCC2)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-001-743-806 0.64 COc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)C(C)(C)C)c12
MolPort-001-743-387 0.64 COCCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccccc3C)c(=O)n1C2
MolPort-039-347-480 0.64 CC(C)CCc1cc(n[nH]1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-045-940-087 0.64 Cc1ccc(o1)-c1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-027-718-488 0.64 Cl.Clc1ccc2nc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc(=O)n2c1
MolPort-038-431-616 0.64 CC(C)CCc1cc(n[nH]1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-701-174 0.64 CC(C)CCc1cc([nH]n1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-700-468 0.64 COc1ccc(CCN2C(=O)N[C@@H](CCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)cc1OC
MolPort-035-701-544 0.64 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCCc1ccco1
MolPort-046-598-050 0.64 COc1cccc(OC)c1C(=O)NC(=S)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MolPort-028-856-944 0.64 CC(C)(C)c1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(Cl)cc1
MolPort-044-563-938 0.64 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCC1CCOCC1
MolPort-046-597-974 0.64 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H]([C@@H]3[C@@H](Cc2c1)C(=O)NCCc1c[nH]c2ccccc12)c1cccc(=O)n1C4
MolPort-035-700-711 0.64 O=C(C[C@@H]1NC(=O)N(CCc2c[nH]c3ccccc23)C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-194-017 0.64 CCc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(Cl)cc2)C1=O
MolPort-046-120-695 0.64 CNC(=O)C(C)(C)CNC(CCCC=C)Cc1ccccn1
MolPort-044-632-838 0.64 O=C(NCc1ccccc1OC1CCC1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-027-718-666 0.64 COc1ccc2c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc(=O)oc2c1
MolPort-046-424-523 0.64 Fc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-814-275 0.64 CC(C)C[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)N1CCN(C\C=C\c2ccccc2)CC1
MolPort-046-423-846 0.64 Clc1ccc2c(c1)[nH]cc(C(=O)N1C[C@H]3C[C@@H](C1)c1cccc(=O)n1C3)c2=O
MolPort-044-565-121 0.64 CN1C(=O)N(C)C(=O)C(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2ccc(C)s2)C1=O
MolPort-042-644-548 0.64 CC(C)C(NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCCc1ccco1
MolPort-044-811-094 0.64 Cn1c(CCCCCNC(=O)[C@@H]2Cc3cc(ccc3N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@@H]23)[N+]([O-])=O)nc2ccccc12
MolPort-035-700-784 0.64 Fc1cccc(CN2C(=O)N[C@@H](CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)c1
MolPort-035-701-785 0.64 Clc1ccc(CN2C(=O)N[C@@H](CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)cc1
MolPort-044-713-880 0.64 Cc1cccc(=O)n1CCC(=O)NC1C2CN3CC1(CN(C2)CC3)c1ccccc1
MolPort-039-193-987 0.64 CN1C(=S)N(C)C(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc3OCOc3c2)C1=O
MolPort-046-482-373 0.64 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1cn2cccnc2n1
MolPort-039-193-963 0.64 COc1ccc(\C=N\NC(=O)CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1CCN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-028-574-843 0.64 O=c1cccc2[C@H]3C[C@H](CN(C3)c3nnc(o3)C3CCC3)Cn12
MolPort-028-854-772 0.64 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCc2ccccc2C1
MolPort-046-597-254 0.64 Clc1ccc2nc(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc(=O)n2c1
MCULE-4137292754 0.64 C1(=O)C2C=CC(=C(C)C=2OC(C)=C1C1=CC=CC=C1)OCC
MolPort-039-194-077 0.64 COc1cccc(OC)c1C(=O)NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-8903120649 0.64 C1(=O)C2C=C(CC)C(=CC=2OC(C)=C1C1C=CC(=CC=1)F)OCC(OC)=O
MolPort-044-632-848 0.64 COc1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c2cccnc12
MCULE-5422255628 0.64 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OCC(N)=O)C=2)CC)C1=O
MolPort-039-194-159 0.64 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1cc2ccccc2o1
MCULE-5442841234 0.64 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OCC(OCC3C=CC=CC=3)=O)C=2)CC)C1=O
MolPort-046-768-552 0.64 Cl.COc1cc2CCN(Cc2cc1OC)C(=O)CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-8122512053 0.64 C1(C2=CC=C3C(OCCCO3)=C2)=COC2C(=CC(=C(OCC3C=CC(=CC=3)OC)C=2)CC)C1=O
MolPort-035-874-094 0.64 COCCn1c(cc2ccccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-6892185151 0.64 C1(C2=CC=CC=C2)=COC2=C(C=CC(=C2)OC(CCCCCCCC)C([O-])=O)C1=O.[Na+]
MolPort-029-885-406 0.64 Fc1cccc(CN2C(=O)N[C@@H](CCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)c1
MCULE-5540192328 0.64 C1(C2C=CC=CC=2)=COC2=C(C=CC(=C2)OC(CCCCCCCC)C(OC)=O)C1=O
MolPort-039-194-099 0.64 CCCCOC(=O)c1ccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MCULE-4863956086 0.64 C1(=O)OC2=CC(=CC=C2C=C1C1=CC=C(C=C1)OC)OCC(=O)C1C=CC(=CC=1)Br
MolPort-039-194-172 0.64 Cc1ccc2[nH]cc(C(N3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)C(O)=O)c2c1
MCULE-7205222484 0.64 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=C(OC)C=3)OCCC3=CC=C4C(CCO4)=C3)C=21)=O)C1=CC=C(C=C1)O
MolPort-044-566-718 0.64 Cc1noc(C)c1CCC(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-9788729007 0.64 C1(C2=CC=CC=C2Cl)=COC2C(=CC=C(C=2)OC(=O)C(C2C=CC=CC=2)C2=CC=CC=C2)C1=O
MolPort-040-583-932 0.64 O=C(Nc1ccc2ccoc2c1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-3496672631 0.64 C1(O)C=C2OC=C(C3C(O)=CC(OC)=CC=3)C(=O)C2=C(O)C=1C/C=C(\C)/C
MolPort-039-194-030 0.64 COc1cc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)cc(I)c1O
MCULE-8016447460 0.64 C12C(O)=CC3=C(C(CC(=O)O3)C3=COC4=C(C=CC=C4)C3=O)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-027-718-834 0.64 Cn1c(N)c(C(=O)CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(=O)n(C)c1=O
MCULE-5179538679 0.64 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)OCCC3=CC=C4C(CCO4)=C3)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-039-194-034 0.64 COc1ccc(Br)cc1CC1(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)C(=O)N(C)C(=O)N(C)C1=O
MCULE-3222804411 0.64 C1(=O)OC2=CC(=CC=C2C=C1C1C=CC=CC=1)OCC(=O)C1C=CC(=CC=1)C
MolPort-020-226-742 0.64 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cccc2ccnn12
MCULE-9004926803 0.64 C12C(O)=CC3=C(C(CC(=O)O3)C3=COC4=C(C=C(C=C4)C)C3=O)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-035-377-462 0.64 CCCCc1nc(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(Cl)[nH]1
MCULE-6316078357 0.64 C12C(O)=CC3=C(C(C4C=CC(=CC=4)O)CC(=O)O3)C=1OC=C(C1=CC=CC=C1OC)C2=O
MolPort-044-478-807 0.64 Cn1cc(CNC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(n1)C(F)(F)F
MCULE-7310620094 0.64 C12C(C/C=C(\C)/C)=C(OC)C(O)=CC=1OC1C=C3OC(C)(C)C(O)CC3=C(O)C=1C2=O
MolPort-044-431-358 0.64 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCCc1nc2ccccc2[nH]1
MCULE-2643755887 0.64 C12C(O)=CC3=C(C(C4=CC=C(C=C4)Cl)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-046-424-700 0.64 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H](C3C(Cc2c1)C(=O)NCCCn1ccnc1)c1cccc(=O)n1C4
MCULE-7904484228 0.64 C1(C2=CC=C(C=C2)N(=O)=O)=COC2=C(C=C(C(OC)=C2)CC)C1=O
MolPort-044-478-902 0.64 O=C(Nc1nccn1-c1ccccc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-1131040890 0.64 C1C=C2C=CC(=O)OC2=C2C[C@@H](C(OC(=O)C)(C)C)OC=12
MolPort-046-681-995 0.64 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H]([C@@H]3[C@@H](Cc2c1)C(=O)NCCCn1ccnc1)c1cccc(=O)n1C4
MCULE-7823427940 0.64 C1(C2=CC=C3C(OCCCO3)=C2)=COC2C(=CC(=C(OCC(=O)C3C=CC(=CC=3)Cl)C=2)CC)C1=O
MolPort-044-544-041 0.64 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCCc1nc2ccccc2[nH]1
MCULE-6724003124 0.64 C12C(OC)=CC3=C(C(CC(=O)O3)C3C=CC=CC=3OCC(C)=C)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-042-598-339 0.64 CN1CCN(CC1)C(=O)CCN1CCCC(C1)c1ccccn1
MCULE-3463113175 0.64 C12C(O)=CC3=C(C(CC(=O)O3)C3=COC4=C(C=C(C=C4)C)C3=O)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-029-943-162 0.64 O[C@H]1CC[C@@H](CCN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)O[C@@H]1C(=O)N1CCN(CC1)c1ccccc1
MCULE-8964848450 0.64 C1(C2=CC=CC=C2)=COC2C(=CC=C(OC)C=2)C1=O
MolPort-040-818-486 0.64 NC1CCC(CC1)NCC1(CCC1)c1ccccn1
MCULE-6667418908 0.64 C12OC=C(C(=O)C=1C=CC1OC(CC(C3C=CC=CC=3OCCC3C=CC4=C(CCO4)C=3)C2=1)=O)C1=CC=C(C(OC)=C1)OC
MolPort-038-398-721 0.64 CCn1c(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)nnc1[C@@H]1C[C@H](N)C1
MCULE-3301414424 0.64 C1(C2=CC=C(C=C2)Cl)=COC2C(=CC(=C(OC(C3C=CC=CC=3)=O)C=2)CCCCCC)C1=O
MolPort-044-810-889 0.64 COCCN(C[C@@H]1CCCN2CCCC[C@H]12)C(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MCULE-5532265840 0.64 Br.C1(C2=CC=C(C=C2)OC)=COC2=C(C=CC(=C2)OC(C(C)N)=O)C1=O
MolPort-044-431-901 0.64 CC(C)Cc1cc([nH]n1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-2291321994 0.64 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC4=C(OCCO4)C=3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-046-597-101 0.64 Fc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-6986102694 0.64 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(O)C=3)OC)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-044-179-943 0.64 Oc1ccc2ccc(=O)oc2c1CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-2020070436 0.64 C12OC=C(C(=O)C1=CC=C(OC)C=2C(C1=CC=C(C=C1)OCC(C)=C)CC(OC)=O)C1=CC=C(C=C1)OC
MolPort-035-700-582 0.64 CC(C)Cc1cc([nH]n1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-4587081026 0.64 C12OC=C(C(=O)C=1C=CC1OC(CC(C3C=CC=CC=3OCCC3=CC=C(C=C3)OC)C2=1)=O)C1=CC=C(C(OC)=C1)OC
MolPort-039-194-070 0.64 Brc1ccc(\C=C\C(=O)NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MCULE-3821010180 0.64 C12OC=C(C(=O)C1=CC=C(OC)C=2C(CC(OC)=O)C1C=CC(=C2C=CC=CC=12)OC)C1=CC=C(C=C1)OC
MolPort-044-564-868 0.64 Oc1ncc(C(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MCULE-7267176276 0.64 C1(C2=CC=C(C=C2)Br)=C(C)OC2C(=CC=C(OCC(=O)C3C=CC(=CC=3)OC)C=2)C1=O
MolPort-035-873-665 0.64 Cc1cc(C)n(CC2CC2)c(=O)c1C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-3507939440 0.64 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=CC=3)OC(C)C)C=21)=O)C1C=CC=CC=1
MolPort-046-168-190 0.64 O=C(CC1(CCOCC1)N1Cc2ccccc2C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-7637084204 0.64 C1(C2C=CC(=CC=2)Br)=COC2C(=CC=C(C=2)OC(C)C(OCC)=O)C1=O
MolPort-046-597-407 0.64 COc1ccc2n(CCNC(=O)[C@@H](NC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(C)C)ccc2c1
MCULE-2058634066 0.64 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)O)C=1OC=C(C1=CC=CC=C1)C2=O
MolPort-035-873-813 0.64 COc1ccc2n(CCNC(=O)[C@@H](NC(=O)N3CC4C[C@@H](C3)c3cccc(=O)n3C4)C(C)C)ccc2c1
MCULE-4457795821 0.64 C1(=COC2=C(C=C(C(OC(C)C(OCC)=O)=C2)CCC)C1=O)C1=CC2=C(C=CC=C2)O1
MolPort-039-193-927 0.64 COc1ccc(\C=C\C(=O)c2ccccc2)cc1CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-4613045834 0.64 C1(C2=CC=C3C(OCCO3)=C2)=COC2=C(C=CC(OC(C)C)=C2)C1=O
MolPort-007-921-248 0.64 Fc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccccc1F
MolPort-046-598-062 0.64 Brc1ccc(\C=C\C(=O)NC(=S)N2C[C@@H]3CC(C2)c2cccc(=O)n2C3)cc1
MCULE-4678923514 0.64 C1(C2C=CC3=C(OCCO3)C=2)=C(C)OC2=C(C=C(C(OC(C)=O)=C2)CCC)C1=O
MolPort-007-920-833 0.64 CC(=O)N1CCN(CC1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O
MolPort-044-431-999 0.64 Cc1cc(C)n(CC2CC2)c(=O)c1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-2203705718 0.64 C1(C2C=CC(=CC=2)OCC(OCC)=O)=COC2C(=CC=C(OCC(OCC(OCC)=O)=O)C=2)C1=O
MolPort-007-931-086 0.63 CCC(C)NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)Nc2ccc(CC)cc2)c1
MolPort-046-597-629 0.63 O=C(C1CN(C(=O)C1)c1ccc2OCCOc2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-574-678 0.63 COc1ccc(OC)c2c(C)cc(nc12)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-007-929-082 0.63 CCCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=S)Nc2ccc(CC)cc2)c1
MolPort-035-702-018 0.63 Cn1nc(cc1C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(C)(C)C
MolPort-007-923-857 0.63 OC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=S)Nc2ccc(Br)cc2)c1
MolPort-001-743-389 0.63 CSCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccccc3C)c(=O)n1C2
MolPort-007-932-445 0.63 CCCCN(C)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=S)Nc2ccc(C)cc2)c1
MolPort-002-009-529 0.63 COc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-007-931-083 0.63 CCc1ccc(NC(=O)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NC2CCCC2)cc1
MolPort-002-520-594 0.63 COc1ccc2n(C)c(C)c(C(=O)CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-003-057-341 0.63 CCC(C)NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccccc2Cl)c1
MolPort-016-604-814 0.63 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1c[nH]nc1-c1ccccc1
MolPort-007-932-543 0.63 CCCCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=S)Nc2ccc(C)c(C)c2)c1
MolPort-044-180-956 0.63 CC(C)Cc1cc(n[nH]1)C(=O)NCCN1CC2CC(C1)c1cccc(=O)n1C2
MolPort-007-922-847 0.63 CC(C)(C)c1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N(CC=C)c1ccccc1
MolPort-007-931-033 0.63 CCc1ccc(NC(=O)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NC2CCCC(C)C2C)cc1
MolPort-007-932-540 0.63 Cc1ccc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCc2ccccc2)cc1C
MolPort-046-115-252 0.63 CC(C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)n1cnc2c(N)ncnc12
MolPort-007-932-443 0.63 CCCCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=S)Nc2ccc(C)cc2)c1
MolPort-001-743-533 0.63 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cncnc3)c(=O)n1C2
MolPort-007-932-538 0.63 Cc1ccc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCCc2ccccc2)cc1C
MolPort-001-744-317 0.63 Fc1ccc(CN2C[C@@H]3C[C@H](C2)c2c(ccc(=O)n2C3)-c2cccc(c2)C#N)cc1
MolPort-007-920-827 0.63 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1cccc(c1)C(F)(F)F
MolPort-001-743-581 0.63 CN(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccc(c3)C#N)c(=O)n1C2
MolPort-007-922-958 0.63 CN(Cc1ccccc1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2cccc(c2)C(F)(F)F)c1
MolPort-002-514-461 0.63 CC(C)(C)OC(=O)CCC(NC(=O)OC(C)(C)C)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-007-923-023 0.63 COc1ccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(N)c2)cc1Cl
MolPort-005-946-314 0.63 CN(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cncnc1
MolPort-007-932-542 0.63 CC(NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=S)Nc2ccc(C)c(C)c2)c1)c1ccccc1
MolPort-002-516-422 0.63 Cc1ccc(cc1)C(=O)NC(NC(=S)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-007-920-835 0.63 CCN(CC)C(=O)C1CCCN(C1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O
MolPort-007-932-528 0.63 Cc1ccc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NC2CCCCCCC2)cc1
MolPort-001-743-427 0.63 FC(F)(F)Oc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)C3CCCCC3)Cn2c1=O
MolPort-040-609-050 0.63 O=C(Nc1cnc2CCCCc2c1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-007-923-177 0.63 FC(F)(F)c1cccc(c1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCC(Cc2ccccc2)CC1
MolPort-001-743-552 0.63 CCCS(=O)(=O)N1C[C@@H]2C[C@H](C1)c1ccc(C3CCCCC3)c(=O)n1C2
MolPort-007-932-552 0.63 Cc1ccc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NC2CC2)cc1C
MolPort-000-774-800 0.63 CN1C(=O)N(C)C(=O)C(CN2CC3CC(C2)c2cccc(=O)n2C3)(Cc2ccc(OCC(O)c3ccccc3)cc2)C1=O
MolPort-007-932-529 0.63 Cc1ccc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCCc2ccccc2)cc1
MolPort-005-910-560 0.63 CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MolPort-007-932-531 0.63 CC(NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=S)Nc2ccc(C)cc2)c1)c1ccccc1
MolPort-001-744-769 0.63 O=C(Cc1ccccc1)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O
MolPort-007-920-856 0.63 COCCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O
MolPort-001-743-795 0.63 CC(=O)Nc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(Cc4cnc5ccccc5c4)C3)Cn2c1=O
MolPort-007-932-533 0.63 Cc1ccc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCc2ccccc2)cc1
MolPort-001-745-135 0.63 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(NC(=O)c3ccccn3)ccc(=O)n1C2
MolPort-007-931-012 0.63 CCc1ccc(NC(=O)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NC2CCCCC2)cc1
MolPort-019-558-358 0.63 CC(=O)c1ccc(NC(=O)CSC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-007-932-526 0.63 CC1CCN(CC1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=S)Nc2ccc(C)cc2)c1
MolPort-019-556-013 0.63 Cc1ccc(NC(=O)CSC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1C
MolPort-038-403-371 0.63 O[C@H]1C[C@H](C1)C(Cc1ccccn1)NC(=O)CCn1c2ccccc2[nH]c1=O
MolPort-039-193-992 0.63 COc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2ccc(cc2)C(C)C)C1=O
MolPort-002-509-576 0.63 O=C(NC(=O)C(=C\c1ccccc1)\C#N)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-744-978 0.63 COCCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)CN(C)C)c(=O)n1C2
MolPort-044-431-353 0.63 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-000-795-304 0.63 COc1ccc(cc1)N1C(=O)NC(=O)C(CN2CC3CC(C2)c2cccc(=O)n2C3)(Cc2ccc(cc2)C(C)C)C1=O
MolPort-007-932-446 0.63 CC(C)CCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=S)Nc2ccc(C)cc2)c1
MolPort-035-701-771 0.63 CC(C)c1cc(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n(C)n1
MolPort-046-107-125 0.63 COc1ncncc1NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-045-957-129 0.63 Cc1cc(C)n(Cc2ccc(cc2)C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n1
MolPort-044-563-949 0.63 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)N1CCSCC1
MolPort-001-743-835 0.63 O=C(N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc2ccccc2c1)c1ccncc1
MolPort-001-744-958 0.63 O=C(Cc1ccccc1)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccc4ccccc4c3)Cn2c1=O
MolPort-001-743-739 0.63 CN(C)Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(Cc4cccc(c4)C#N)C3)Cn2c1=O
MolPort-005-910-992 0.63 OC(=O)C(N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1c[nH]c2cc(F)ccc12
MolPort-044-564-846 0.63 CC(C)Cc1cc([nH]n1)C(=O)NCCN1CC2CC(C1)c1cccc(=O)n1C2
MolPort-042-559-136 0.63 CN1CCC(CCC(=O)NCCc2cccc(=O)[nH]2)CC1
MolPort-044-543-943 0.63 COc1ccc(CC(=O)N2C[C@H]3C[C@H](C2)c2ccc([N+]([O-])=O)c(=O)n2C3)cc1
MolPort-035-775-560 0.63 Cl.Cl.Cl.NC1(Cc2ccccn2)CCNCC1
MolPort-027-564-159 0.63 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCN(Cc2ccccc2)CC1
MolPort-002-026-027 0.63 CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-044-543-883 0.63 O=C(COc1ccccc1-n1cnnc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-519-288 0.63 Cc1cc(C)c2n(CC(O)CN3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)c(c(-c3ccccc3)c2c1)-c1ccccc1
MolPort-035-873-165 0.63 CC(C)NC(=O)c1ccccc1NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-728-641 0.63 CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CC2C[C@H](C1)c1cccc(=O)n1C2
MolPort-000-853-987 0.63 CN1CCN(CC1)C(=O)Cc1cn(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-001-744-454 0.63 COc1ccc(CC(=O)Nc2ccc3[C@@H]4C[C@@H](CN(C4)C(C)=O)Cn3c2=O)cc1
MolPort-009-745-139 0.63 O=C(\C=C\c1cccs1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-035-873-638 0.63 COc1ccc(cc1)N1C(=O)N[C@@H](CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MolPort-039-195-401 0.63 O=C(NCc1ccc2OCOc2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-744-174 0.63 CN(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc(NC(C)=O)cc1
MolPort-039-194-091 0.63 CCOC(=O)c1cccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MolPort-035-701-035 0.63 Clc1cccc(CN2C(=O)N[C@@H](CC(=O)N3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)c1
MolPort-002-515-010 0.63 Cc1ccc2[nH]c3CCN(Cc3c2c1)C(=O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-518-725 0.63 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(OC(F)(F)F)cc1
MolPort-009-745-137 0.63 O=C(Cc1noc2ccccc12)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-042-671-848 0.63 COc1ccc(cc1)N1C(=O)NC(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MolPort-001-743-774 0.63 O=c1c(ccc2[C@@H]3C[C@@H](CN(Cc4cnc5ccccc5c4)C3)Cn12)-c1cccc(c1)C#N
MolPort-019-558-500 0.63 Clc1ccccc1NC(=O)CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-005-977-775 0.63 Clc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-044-543-435 0.63 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCc1c[nH]c2ccccc12
MolPort-001-743-638 0.63 COc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(Cc4cccc(c4)C#N)C3)Cn2c1=O
MolPort-039-194-009 0.63 CC(=O)Nc1ccc(cc1)S(=O)(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-005-910-207 0.63 Clc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MolPort-002-517-599 0.63 CSCC[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(NC(C)=O)cc1
MolPort-002-517-022 0.63 CCOC(=O)c1cccc(NC(=S)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MolPort-002-518-551 0.63 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(Br)cc1F
MolPort-001-743-751 0.63 O=c1c(ccc2[C@@H]3C[C@@H](CN(Cc4cccc(c4)C#N)C3)Cn12)-c1cncnc1
MCULE-7653620154 0.63 C12C(O)=CC3=C(C(C4C=CC(=CC=4)OCC(N)=O)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-002-511-572 0.63 CCOc1ccc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C2=O)c2ccccc2)cc1
MolPort-002-516-577 0.63 Clc1ccc(\C=C\C(=O)NC(=S)N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MCULE-7053385691 0.63 O(C1C2C(C=C(C)OC=2C=C2O[C@H](C(C)(C)O[C@H]3[C@@H]([C@@H](O)[C@H](O)[C@@H](CO[C@@H]4OC[C@](O)(CO)[C@H]4O)O3)O)CC=12)=O)C
MolPort-001-744-972 0.63 CN(C)CC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccc4ccccc4c3)Cn2c1=O
MolPort-005-979-574 0.63 Cc1c(O)ccc2c(CN3CC4CC(C3)c3cccc(=O)n3C4)cc(=O)oc12
MCULE-1561798023 0.63 C1(C2C=CC(=CC=2)OCC2C=CC=CC=2)=COC2C(=CC=C(OCC3C=CC=CC=3)C=2)C1=O
MolPort-001-743-621 0.63 CC(=O)Nc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O
MolPort-002-515-698 0.63 O=C(N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2OCCOCCOc3cc(ccc3OCCOCCOc2c1)C(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-6990143122 0.63 C1(=O)C(C2=CC=C3C(OCCO3)=C2)=COC2C=C(O)C=C(O)C1=2
MolPort-002-518-945 0.63 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1cc(Cl)ccc1C
MolPort-039-194-166 0.63 OC(=O)C(N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)c1c[nH]c2cc(Cl)ccc12
MCULE-7779883645 0.63 C1(C2=CC=CC=C2Cl)=COC2C(=CC(=C(OCC3C=CC=CC=3)C=2)CC)C1=O
MolPort-002-518-293 0.63 CCOc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-046-107-125 0.63 COc1ncncc1NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-5679241245 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=C(OC)C(=C(OC)C=3)O)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-001-744-449 0.63 CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)c3ccc(cc3)C#N)c(=O)n1C2
MolPort-046-482-368 0.63 Cc1cc(on1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-7215491186 0.63 C1(C2=CC=C3C(OCCO3)=C2)=C(C)OC2C(=CC(=C(OCC(OCC)=O)C=2)CC)C1=O
MolPort-019-556-017 0.63 CC(SC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccccc1F
MolPort-044-431-172 0.63 COc1cccc2[nH]c(cc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-5650610801 0.63 C1(C2=CC=C3C(OCO3)=C2)=C(C)OC2=C(C=C(C(OC(C)C)=C2)CCC)C1=O
MolPort-001-743-309 0.63 OC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(Cl)cc3)c(=O)n1C2
MolPort-044-181-248 0.63 COc1cc2cc([nH]c2cc1OC)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-2610960536 0.63 C1(C2C=CC3=C(OCCO3)C=2)=C(CC)OC2=C(C=C(C(O)=C2)CCC)C1=O
MolPort-008-326-612 0.63 Cc1ccnc(CC2CCCCCN2)c1
MolPort-039-194-074 0.63 O=C(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1cccs1
MCULE-7153061001 0.63 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(OCC)C=2)C1=O
MolPort-005-946-299 0.63 O=c1c(ccc2[C@@H]3C[C@@H](CN(Cc4ccccn4)C3)Cn12)-c1cccc(c1)C#N
MolPort-044-543-588 0.63 Cc1cc(=O)c(OCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cn1C
MCULE-3176071530 0.63 C1(C2=CC=C(C(OC)=C2)OC)=COC2C(=CC=C(OCC(C)=C)C=2)C1=O
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MCULE-9906460340 0.63 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC(=C(OC(=O)C3=CC=C(C=C3)C(C)(C)C)C=2)CCCCCC)C1=O
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MCULE-7357379395 0.63 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC=C(OC)C=3)C=21)=O)C1=CC=C(C=C1)O
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MCULE-6603203678 0.63 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(OCC3C=CC(=CC=3)C)C=2)C1=O
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MolPort-039-193-995 0.63 CCOc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(C)cc2)C1=O
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MCULE-4801382202 0.63 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(OCC(C)=C)C=2)C1=O
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MCULE-3608011170 0.63 C1(C2=CC=C(C=C2)Cl)=COC2C(=CC=C(C=2)OC(C)C(O)=O)C1=O
MolPort-002-511-609 0.63 COc1ccccc1CC1(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(=O)NC(=O)N(C1=O)c1ccccc1
MolPort-042-559-015 0.63 C[C@H]1CCC[C@@H](C)N1CC(=O)NCCc1cccc(=O)[nH]1
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MCULE-5588697277 0.63 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OCC3=CC=C(C=C3)Br)C=2)CC)C1=O
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MolPort-001-744-235 0.63 COc1ccc(CN2C[C@@H]3C[C@H](C2)c2c(ccc(=O)n2C3)-c2ccccc2F)cc1
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MCULE-1520717775 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=C(OC)C4=C(OCCO4)C=3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-027-718-778 0.63 Cl.O=c1cccc2[C@H]3C[C@H](CN(Cc4nc(no4)-c4ccccc4)C3)Cn12
MolPort-027-718-422 0.63 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCOCC1
MCULE-6907378807 0.63 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=C(OCCC4=CC=C(C=C4)OC)C=3)OC)C=21)=O)C1C=CC=CC=1
MolPort-001-743-296 0.63 Clc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O
MolPort-035-873-429 0.63 COc1cccc2n(CCNC(=O)[C@@H](NC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(C)C)ccc12
MCULE-2861207948 0.63 C12OC=C(C(=O)C1=CC=C(O)C=2C(C1C=CC(=CC=1)OCC(C)=C)CC(OC)=O)C1=CC=C(C=C1)O
MolPort-035-873-429 0.63 COc1cccc2n(CCNC(=O)[C@@H](NC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(C)C)ccc12
MolPort-044-543-966 0.63 COc1ccc(CCC(=O)N2C[C@H]3C[C@H](C2)c2ccc([N+]([O-])=O)c(=O)n2C3)cc1
MCULE-9559942895 0.63 C12C(O)=CC3=C(C(C4=CC=C(C=C4)C(O)=O)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-002-110-420 0.63 Clc1ccc(Cl)c(c1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-027-718-778 0.63 Cl.O=c1cccc2[C@H]3C[C@H](CN(Cc4nc(no4)-c4ccccc4)C3)Cn12
MCULE-2590291331 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)OC(C)C)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-039-194-170 0.63 OC(=O)C(N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)c1c[nH]c2cc(F)ccc12
MolPort-029-886-501 0.63 COc1ccc(CN2C(=O)N[C@@H](CCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)cc1
MCULE-2445134951 0.63 C1(C2C=CC=CC=2Cl)=COC2=C(C=CC(OCC)=C2C)C1=O
MolPort-002-512-173 0.63 COc1cc(OC)c(OC)cc1CC1(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(=O)N(C)C(=O)N(C)C1=O
MolPort-020-204-432 0.63 CN(CCc1ccccn1)C[C@@H]1CCCN2CCCC[C@H]12
MCULE-7887015167 0.63 C12OC=C(C(=O)C1=CC=C(O)C=2C(CC(OC)=O)C1C=CC(=CC=1OC)OC)C1=CC=C(C=C1)O
MolPort-046-423-430 0.63 COc1ccc(CCC(=O)N2C[C@H]3C[C@@H](C2)c2ccc([N+]([O-])=O)c(=O)n2C3)cc1
MolPort-039-193-968 0.63 COc1ccc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C2=O)c2ccc(OC)cc2)cc1
MCULE-7361371388 0.63 C12C(O)=CC3=C(C(C4=CC=C(C=C4)OCC(N)=O)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-039-193-937 0.63 CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2sccc2C)C1=O
MolPort-028-856-117 0.63 COc1ccc(nn1)N1CCCC(C1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-1911979431 0.63 C12C(O)=CC3=C(C(C4C=CC(=CC=4)OC)CC(=O)O3)C=1OC=C(C1=CC=CC=C1OC)C2=O
MolPort-005-979-505 0.63 OC(=O)C(N1CC2CC(C1)c1cccc(=O)n1C2)c1c[nH]c2cc(F)ccc12
MolPort-039-193-995 0.63 CCOc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(C)cc2)C1=O
MCULE-4213668369 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=CC=3OC)OC)C=1OC=C(C1=CC=C(C=C1)Cl)C2=O
MolPort-001-743-112 0.63 Fc1ccc(CN2C[C@@H]3C[C@H](C2)c2ccc(NC(=O)Nc4ccccc4)c(=O)n2C3)cc1
MolPort-039-343-017 0.63 CC(NS(=O)(=O)c1ccc(Cl)cc1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-7070801218 0.63 C1(C2C=CC=CC=2)=COC2C(=CC=C(OC/C=C(\C)/C)C=2)C1=O
MolPort-001-743-668 0.63 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccs3)c(=O)n1C2
MolPort-042-644-499 0.63 COc1cccc2n(CCNC(=O)C(NC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(C)C)ccc12
MCULE-4274899444 0.63 C1(C2=CC=C(C=C2)Br)=COC2C(=CC=C(OCCBr)C=2)C1=O
MolPort-001-744-126 0.63 CN(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cccc(c1)C#N
MolPort-035-775-560 0.63 Cl.Cl.Cl.NC1(Cc2ccccn2)CCNCC1
MCULE-8044852635 0.63 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(C=2)OC(=O)C(C)(C)C)C1=O
MolPort-000-756-605 0.63 COc1c(Br)cc(Br)cc1CC1(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)C(=O)N(C)C(=O)N(C)C1=O
MolPort-042-698-672 0.63 Clc1sccc1NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-2349511317 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3=COC4=C(C=C(C=C4)OC)C3=O)C=1OC=C(C1=CC=CC=C1)C2=O
MolPort-000-770-079 0.63 COc1cc(CC2(CN3C[C@H]4CC(C3)c3cccc(=O)n3C4)C(=O)N(C)C(=S)N(C)C2=O)ccc1OCc1ccccc1
MolPort-039-194-009 0.63 CC(=O)Nc1ccc(cc1)S(=O)(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-4462598749 0.63 C1(C2=CC=C(C=C2)Br)=COC2C(=CC=C(C=2)OC(=O)C2CC2)C1=O
MolPort-044-543-966 0.63 COc1ccc(CCC(=O)N2C[C@H]3C[C@H](C2)c2ccc([N+]([O-])=O)c(=O)n2C3)cc1
MolPort-035-873-638 0.63 COc1ccc(cc1)N1C(=O)N[C@@H](CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MCULE-5207010381 0.63 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC=C(OC)C=3OCCC3C=CC(=CC=3)OC)C=21)=O)C1C=CC=CC=1
MolPort-039-193-983 0.63 COc1cc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=S)N(C)C2=O)ccc1OCc1ccccc1
MolPort-042-671-848 0.63 COc1ccc(cc1)N1C(=O)NC(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MCULE-5254339970 0.63 C1(C(F)(F)F)OC2C=C(OCC)C(=CC=2C(=O)C=1C1=CC=CC=C1)CC
MolPort-023-299-948 0.63 Clc1ccc(Cl)c(c1)S(=O)(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-035-701-035 0.63 Clc1cccc(CN2C(=O)N[C@@H](CC(=O)N3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)c1
MCULE-1535055127 0.63 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC=C(OC)C=3OCCC3C=CC4=C(CCO4)C=3)C=21)=O)C1C=CC=CC=1
MolPort-039-057-075 0.63 COc1ccc(CCn2cc(C(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c3ccccc3c2=O)cc1
MolPort-044-431-353 0.63 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCc1c[nH]c2ccccc12
MCULE-3418911831 0.63 C1(C2C=CC3=C(OCCO3)C=2)=COC2=C(C=CC(OC)=C2)C1=O
MolPort-007-922-927 0.63 COC(=O)c1cc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(N)c2)cc(c1)C(=O)OC
MolPort-044-563-949 0.63 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)N1CCSCC1
MCULE-1744130314 0.63 C12C(O)=CC3=C(C(C4C=CC(=CC=4)O)CC(=O)O3)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-007-923-095 0.63 CC(=O)c1cccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3ccccc3Cl)c2)c1
MolPort-044-543-435 0.63 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCc1c[nH]c2ccccc12
MCULE-3904729840 0.63 C12C(O)=CC3=C(C(C4=CC=C(C=C4)OCC(C)C)CC(=O)O3)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-007-923-022 0.63 Clc1ccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3ccccc3Cl)c2)cc1
MolPort-038-403-371 0.63 O[C@H]1C[C@H](C1)C(Cc1ccccn1)NC(=O)CCn1c2ccccc2[nH]c1=O
MCULE-9021048470 0.63 C1(C2=CC=C(C=C2)Cl)=COC2C(=CC=C(OC(CC)=O)C=2)C1=O
MolPort-046-768-543 0.63 Clc1nc(N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2nc[nH]c2n1
MolPort-046-598-055 0.63 COc1ccc(\C=C\C(=O)NC(=S)N2C[C@@H]3CC(C2)c2cccc(=O)n2C3)cc1
MCULE-8794569817 0.63 C12C(O)=CC3=C(C(C4CCC=CC4)CC(=O)O3)C=1OC=C(C1=CC=CC=C1)C2=O
MolPort-002-518-961 0.63 O=C(Nc1ccc(Oc2ccccc2)cc1)[C@H](Cc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-023-299-948 0.63 Clc1ccc(Cl)c(c1)S(=O)(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-3122630516 0.63 C12C(O)=CC3=C(C(C4=CC=CC=C4)CC(=O)O3)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-007-931-013 0.63 CCc1ccc(NC(=O)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCCC(C)C)cc1
MolPort-046-423-430 0.63 COc1ccc(CCC(=O)N2C[C@H]3C[C@@H](C2)c2ccc([N+]([O-])=O)c(=O)n2C3)cc1
MCULE-2737469612 0.63 C1(C2C=CC(=CC=2OC)OC)=CC2=CC=C(C=C2OC1=O)OCC(=O)C1C=CC(=CC=1)OC
MolPort-007-923-185 0.63 CC(C)(C)c1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCN(Cc2ccccc2)CC1
MolPort-027-718-580 0.63 COC(=O)[C@@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccccc1
MCULE-4906133976 0.63 C1(C2C=CC=CC=2OC)=COC2C(=C(OC)C=C(OC)C=2)C1=O
MolPort-007-922-964 0.63 CCC(C)NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2cccc(c2)C(F)(F)F)c1
MolPort-040-589-220 0.63 Cc1csc(CNC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MCULE-5465524292 0.63 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(OCCN3CCOCC3)C=2C)C1=O
MolPort-044-543-961 0.63 [O-][N+](=O)c1ccc2[C@H]3C[C@@H](CN(C3)C(=O)CCCCC3CCSS3)Cn2c1=O
MolPort-030-042-378 0.63 COC(=O)C(NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2)c1ccccc1
MCULE-8712482091 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=C(OC)C=3OCCC3C=CC=CC=3)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-007-920-925 0.63 COc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1cccc(c1)C(C)=O
MolPort-044-180-914 0.63 COCCn1c(cc2ccccc12)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-2155278168 0.63 C1(C2=CC=C(C=C2)Br)=COC2C(=CC=C(OCC(OCC)=O)C=2)C1=O
MolPort-001-744-808 0.63 O=C(Cc1ccccc1)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)NC3CCCCC3)Cn2c1=O
MolPort-044-543-516 0.63 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)N1CCc2ccccc2C1
MCULE-6911665876 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)OCCC3=CC=C(C=C3)OC)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-007-931-011 0.63 CCc1ccc(NC(=O)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCc2ccccc2)cc1
MolPort-039-194-163 0.63 COC(=O)[C@@H]1Cc2cc(ccc2N2C[C@H]3C[C@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MCULE-7137219172 0.63 C12OC=C(C(=O)C1=CC=C(O)C=2C(CC(OC)=O)C1C=CC=CC=1OC)C1=CC=C(C=C1)O
MolPort-001-744-764 0.63 O=c1c(ccc2[C@@H]3C[C@@H](CN(CC4CCCCC4)C3)Cn12)-c1ccccc1CN1CCOCC1
MolPort-044-810-965 0.63 CCOC(=O)C1CCN(CC1)C(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MCULE-7593129639 0.63 C1(C2=CC=C3C(OCCCO3)=C2)=C(C)OC2C(=CC(=C(O)C=2)CCC)C1=O
MolPort-007-921-084 0.63 Fc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCCCCC1
MolPort-044-180-956 0.63 CC(C)Cc1cc(n[nH]1)C(=O)NCCN1CC2CC(C1)c1cccc(=O)n1C2
MCULE-3501146203 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3=COC4=C(C=C(C=C4)OC)C3=O)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-046-423-770 0.63 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H](C3C(Cc2c1)C(=O)NCCC1=CCCCC1)c1cccc(=O)n1C4
MolPort-039-195-401 0.63 O=C(NCc1ccc2OCOc2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-4197521119 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC(C)C)C=3)OC)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-044-543-615 0.63 [O-][N+](=O)c1ccc2C3CC(CN(C3)C(=O)C3CCC(Cn4cnnn4)CC3)Cn2c1=O
MolPort-044-478-596 0.63 O=C(Nc1cc(ccn1)C1CC1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-7250697096 0.63 C1(C2C=CC=CC=2)=C(C)OC2C(=CC=C(OCCOC3=CC=C4C(OC(=C(C5C=CC=CC=5)C4=O)C)=C3)C=2)C1=O
MolPort-007-920-878 0.63 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)NCc1ccc(F)cc1
MolPort-039-194-091 0.63 CCOC(=O)c1cccc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MCULE-4171151967 0.63 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(O)C=2)C1=O
MolPort-007-931-035 0.63 CCc1ccc(NC(=O)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCCc2ccccc2)cc1
MolPort-035-701-771 0.63 CC(C)c1cc(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n(C)n1
MCULE-4565670986 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=C(OC)C=3OCCC3C=CC(=CC=3)OC)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-007-923-113 0.63 CC(=O)c1cccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3c(F)cccc3F)c2)c1
MolPort-035-873-165 0.63 CC(C)NC(=O)c1ccccc1NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-3429859185 0.63 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(OCC(C)=C)C=2)C1=O
MolPort-002-666-982 0.63 Fc1ccc2[nH]c3c(ncnc3c2c1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-035-701-815 0.63 Clc1cc(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)on1
MCULE-6690184777 0.63 C1(C2C=CC3=C(OCCO3)C=2)=C(C)OC2=C(C=C(C(OCC(O)=O)=C2)CC)C1=O
MolPort-007-921-230 0.63 Fc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(F)c(F)c1
MolPort-044-543-883 0.63 O=C(COc1ccccc1-n1cnnc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-6471742821 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)OCCC3=CC=CC=C3)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-039-194-280 0.63 Fc1ccc2[nH]c3c(ncnc3c2c1)N1C[C@H]2CC(C1)c1cccc(=O)n1C2
MolPort-039-194-069 0.63 Clc1ccc(\C=C\C(=O)NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MCULE-9903870825 0.63 C12OC=C(C(=O)C1=CC=C(OC)C=2C(CC(OC)=O)C1C=C(OC)C2=C(OCCO2)C=1)C1=CC=C(C=C1)OC
MolPort-042-559-015 0.63 C[C@H]1CCC[C@@H](C)N1CC(=O)NCCc1cccc(=O)[nH]1
MolPort-035-702-018 0.63 Cn1nc(cc1C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(C)(C)C
MCULE-9097524411 0.63 C12C(O)=CC3=C(C(C4C=CC(=CC=4)OC)CC(=O)O3)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-001-744-037 0.63 O=C(N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cccnc1)c1ccccc1
MolPort-046-595-423 0.63 O=C(NCc1ccc2OCOc2c1)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-8858323711 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=C(OC)C=3OC)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-046-424-694 0.63 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)CCCC[C@@H]3CCSS3)Cn2c1=O
MolPort-029-884-949 0.63 CC(C)n1nnc(n1)-c1ccc(cc1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-8739174224 0.63 C1(=O)C2C=C(CC)C(=CC=2OC(C)=C1C1C=CC(=CC=1)F)OC(C)=O
MolPort-044-810-965 0.63 CCOC(=O)C1CCN(CC1)C(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MolPort-039-056-753 0.63 O=C(C1CN(C(=O)C1)c1ccc2OCCOc2c1)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-3149651533 0.63 C1(C(F)(F)F)OC2C=C(OC(C)C)C(=CC=2C(=O)C=1C1C=CC=CC=1)CC
MolPort-001-744-795 0.63 COCCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)Cc3ccccc3)c(=O)n1C2
MolPort-044-544-234 0.63 [O-][N+](=O)c1ccc2[C@@H]3C[C@H](CN(C3)C(=O)C3CN(C(=O)C3)c3ccccc3)Cn2c1=O
MCULE-5713496829 0.63 C1(C2=CC=C(C=C2)OC)=C(C)OC2C(=CC=C(OC(CC)=O)C=2)C1=O
MolPort-044-544-370 0.63 COc1ccc2n(CCCNC(=O)[C@@H]3Cc4cc(ccc4N4C[C@@H]5C[C@@H](Cn6c5cccc6=O)[C@@H]34)[N+]([O-])=O)ccc2c1
MolPort-046-574-678 0.63 COc1ccc(OC)c2c(C)cc(nc12)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-9307514700 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=C(OC)C(=C(OC)C=3)O)C=1OC=C(C1=CC=CC=C1)C2=O
MolPort-002-518-132 0.63 COc1cccc(NC(=O)[C@@H](NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(C)C)c1
MolPort-046-597-629 0.63 O=C(C1CN(C(=O)C1)c1ccc2OCCOc2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-9154080311 0.63 C1(C2C=CC(=CC=2)OC)=C(C)OC2C(=CC=C(C=2)OC(=O)C(C)(C)C)C1=O
MolPort-019-625-294 0.63 Cc1cc(C)cc(NC(=O)CSC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)c1
MolPort-046-423-649 0.63 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)C3CN(C(=O)C3)c3ccccc3)Cn2c1=O
MCULE-3232229853 0.63 C1(=C2C[C@@H](C(O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)(C)C)OC2=CC2OC(=CC(=O)C=21)C)OC
MolPort-019-622-987 0.63 Brc1ccccc1NC(=O)CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-042-559-136 0.63 CN1CCC(CCC(=O)NCCc2cccc(=O)[nH]2)CC1
MCULE-2501571741 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)OC)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-001-743-312 0.63 Clc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)NC3CCCCC3)Cn2c1=O
MolPort-046-682-021 0.63 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H]([C@@H]3[C@@H](Cc2c1)C(=O)NCCC1=CCCCC1)c1cccc(=O)n1C4
MCULE-7243625996 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)O)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-046-597-708 0.63 CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-046-423-864 0.63 COc1ccc(CC(=O)N2C[C@H]3C[C@@H](C2)c2ccc([N+]([O-])=O)c(=O)n2C3)cc1
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MolPort-005-946-265 0.63 COc1ccc(cc1)C(=O)Nc1ccc2[C@H]3CNC[C@H](C3)Cn2c1=O
MolPort-046-115-252 0.63 CC(C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)n1cnc2c(N)ncnc12
MCULE-8332286794 0.63 C1(C2=CC=CC=C2F)=COC2=C(C=CC(OCC(OCC)=O)=C2C)C1=O
MolPort-038-425-947 0.63 O[C@H]1C[C@H](C1)C(Cc1ccccn1)NC1CCC2(CCNCC2)CC1
MolPort-044-431-902 0.63 Cn1nc(cc1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2)C(C)(C)C
MCULE-4013409040 0.63 C1(=O)OC2=CC(OCCCC)=CC=C2C=C1C1C=CC(=CC=1)OC
MolPort-038-389-920 0.63 O[C@H]1C[C@@H](C1)C(Cc1ccccn1)NC1CCC2(CCNCC2)CC1
MolPort-044-543-943 0.63 COc1ccc(CC(=O)N2C[C@H]3C[C@H](C2)c2ccc([N+]([O-])=O)c(=O)n2C3)cc1
MCULE-2234787554 0.63 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=C(OCCC4=CC=C5C(CCO5)=C4)C=3)OC)C=21)=O)C1C=CC=CC=1
MolPort-044-181-170 0.63 CNC(=O)C1(Cc2cc(ccc2N2C[C@H]3C[C@@H]([C@H]12)c1cccc(=O)n1C3)[N+]([O-])=O)C(O)=O
MolPort-044-810-771 0.63 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCCn1ccnc1
MCULE-2239684481 0.63 C1(=O)OC2=CC(=CC=C2C=C1C1=CC=C(C=C1)OC)OCC(=O)C1C=CC(=CC=1)F
MolPort-039-194-163 0.63 COC(=O)[C@@H]1Cc2cc(ccc2N2C[C@H]3C[C@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MolPort-038-389-920 0.63 O[C@H]1C[C@@H](C1)C(Cc1ccccn1)NC1CCC2(CCNCC2)CC1
MCULE-1162332498 0.63 C1(C2C=CC=CC=2)=C(C)OC2C(=CC=C(OCC(=O)C3C=CC(=CC=3)F)C=2)C1=O
MolPort-044-543-516 0.63 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)N1CCc2ccccc2C1
MolPort-038-425-947 0.63 O[C@H]1C[C@H](C1)C(Cc1ccccn1)NC1CCC2(CCNCC2)CC1
MCULE-7278134598 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=C(OC)C(=C(OC)C=3)OC)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-046-068-409 0.63 COc1ccc(CCNC(=O)[C@@H]2Cc3cc(NC(C)=O)ccc3N3C[C@H]4C[C@@H]([C@H]23)c2cccc(=O)n2C4)cc1OC
MolPort-039-193-992 0.63 COc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2ccc(cc2)C(C)C)C1=O
MCULE-5872074929 0.63 C1(C2=CC=C(C(OC)=C2)OC)=COC2C(=CC=C(C=2)OC(=O)C(C)(C)C)C1=O
MolPort-044-565-269 0.63 CNC(=O)C1(Cc2cc(ccc2N2C[C@H]3C[C@@H](C12)c1cccc(=O)n1C3)[N+]([O-])=O)C(O)=O
MolPort-035-700-729 0.63 COc1ccc(CCN2C(=O)N[C@@H](CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)cc1OC
MCULE-6601494352 0.63 C12OC(C)(C)CCC1=C1C(=O)C3C(O)=C4CCC(C)(C)OC4=CC=3OC1=CC=2O
MolPort-039-194-156 0.63 CN1C(=O)N(C)C(=O)C2(Cc3cc(ccc3N3C[C@@H]4C[C@H]([C@@H]23)c2cccc(=O)n2C4)[N+]([O-])=O)C1=O
MolPort-046-597-708 0.63 CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-5800731793 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=CC=3OC)OC)C=1OC=C(C1=CC=CC=C1OC)C2=O
MolPort-046-597-903 0.63 COC(=O)c1ccc(NC(=O)CCNC(=O)[C@@H]2Cc3cc(NC(C)=O)ccc3N3C[C@H]4C[C@@H]([C@H]23)c2cccc(=O)n2C4)cc1
MolPort-046-596-921 0.63 COc1cc2cc([nH]c2cc1OC)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-7773530953 0.63 CC1=C(C2=CC=C(F)C=C2)C(=O)C2=C(C=C(C=C2)OCC(C2=CC=C(F)C=C2)=O)O1
MolPort-005-976-129 0.63 COC(=O)C1Cc2cc(ccc2N2CC3CC(Cn4c3cccc4=O)C12)[N+]([O-])=O
MolPort-044-432-027 0.63 Clc1cc(CCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)on1
MCULE-1874615586 0.63 CC1=C(C2=CC=C(F)C=C2)C(=O)C2=C(C=C(C=C2)OCC(C2=CC=CC=C2)=O)O1
MolPort-044-810-771 0.63 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCCn1ccnc1
MolPort-046-596-536 0.63 CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2ccc(OCC(O)c3ccccc3)cc2)C1=O
MCULE-1109224964 0.63 C12C(O)=CC3=C(C(C4=CC=C(C=C4)OCC(OC)=O)CC(=O)O3)C=1OC=C(C1=CC=CC=C1OC)C2=O
MolPort-005-910-280 0.63 COC(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MolPort-040-609-050 0.63 O=C(Nc1cnc2CCCCc2c1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-7455024466 0.63 CC(OC1=CC2=C(C(C(C3=CC=C(F)C=C3)=CO2)=O)C=C1)C
MolPort-046-423-512 0.63 COc1ccc(CCNC(=O)C2Cc3cc(NC(C)=O)ccc3N3C[C@H]4C[C@@H](C23)c2cccc(=O)n2C4)cc1OC
MolPort-039-194-043 0.63 CN1C(=O)N(C)C(=O)C(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(OCC(O)c3ccccc3)cc2)C1=O
MCULE-8750647157 0.63 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(C=2)OC(C(C)C)=O)C1=O
MolPort-046-682-021 0.63 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H]([C@@H]3[C@@H](Cc2c1)C(=O)NCCC1=CCCCC1)c1cccc(=O)n1C4
MolPort-035-874-192 0.63 O=C([C@H](c1ccccc1)n1cnnn1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-9606983939 0.63 O([C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O)C(C)(C)[C@@H]1CC2=C(C3C(C=C(C)OC=3C=C2O1)=O)OC
MolPort-000-761-755 0.63 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccc2OCCOCCOc3cc(ccc3OCCOCCOc2c1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-020-232-155 0.63 O=c1cccc2[C@H]3C[C@H](CN(Cc4cc5CNCCn5n4)C3)Cn12
MCULE-3172838243 0.63 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(OC(CC)=O)C=2)C1=O
MolPort-039-194-074 0.63 O=C(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1cccs1
MolPort-045-957-129 0.63 Cc1cc(C)n(Cc2ccc(cc2)C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n1
MCULE-1452910284 0.63 C1(=O)C2=CC=C(C(C)=C2OC(C)=C1C1=CC=C(C=C1)OC)OCC(OCC)=O
MolPort-042-557-810 0.63 CCCC[C@@H]1C[C@@H]1C(=O)NCCc1cccc(=O)[nH]1
MolPort-027-564-159 0.63 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCN(Cc2ccccc2)CC1
MCULE-4253011527 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=C(OC)C(=C(OC)C=3)O)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-005-910-148 0.63 COC(=O)c1ccccc1NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-597-009 0.63 Clc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-7630293313 0.63 C1(C=C2C(C(=O)C(=CO2)C2C=CC(O)=CC=2)=C(C=1C/C=C(\C)/C)O)O
MolPort-001-743-766 0.63 Oc1ccccc1CN1C[C@@H]2C[C@H](C1)c1ccc(\C=C\c3ccc(Cl)cc3)c(=O)n1C2
MolPort-044-564-846 0.63 CC(C)Cc1cc([nH]n1)C(=O)NCCN1CC2CC(C1)c1cccc(=O)n1C2
MCULE-4781026131 0.63 C1(C2=CC=C(C=C2)Cl)=C(C)OC2C(=CC=C(OCC(C3C=CC=CC=3)=O)C=2)C1=O
MolPort-046-482-368 0.63 Cc1cc(on1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-4652906172 0.63 C12C(O)=CC3=C(C(C4=CC=C(C=C4)C(O)=O)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-009-745-136 0.63 O=C(N1CC2CC(C1)c1cccc(=O)n1C2)c1ccc2ncsc2c1
MCULE-4536287471 0.63 C12OC(C)(C)C=CC1=C1OC=C(C3C=CC(O)=CC=3O)C(=O)C1=C(O)C=2CC(O)C(C)=C
MolPort-000-726-049 0.63 O=C(N1CC2CC(C1)c1cccc(=O)n1C2)c1ccc2OCCOCCOc3cc(ccc3OCCOCCOc2c1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-4360256478 0.63 C1(C2C=CC3=C(OCCO3)C=2)=C(CCC)OC2=C(C=C(C(OC(C)C)=C2)CC)C1=O
MolPort-000-745-709 0.63 CC(O)=O.Oc1cc(=O)[nH]c(SCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)n1
MCULE-9170251531 0.63 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(C=2)OC(C(C)C)=O)C1=O
MolPort-044-431-172 0.63 COc1cccc2[nH]c(cc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-7422462794 0.63 C1(C2C=CC3=C(OCO3)C=2)=COC2=C(C=C(C(OC(C)=O)=C2)CC)C1=O
MolPort-002-736-376 0.63 O=C(NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cccs1
MCULE-1871020841 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=C(OC)C=3OC)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-027-718-805 0.63 Fc1ccc(cc1)-n1nnnc1CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-8982199609 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3=CC(OC)=CC=C3OC)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-007-615-499 0.63 Brc1cccc(c1)-c1nnc(CN2CC3CC(C2)c2cccc(=O)n2C3)o1
MCULE-4242046111 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(Cl)C=3)O)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-001-743-306 0.63 COCCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(Cl)cc3)c(=O)n1C2
MCULE-5158335816 0.63 C12OC=C(C(=O)C1=CC=C(O)C=2C(CC(OC)=O)C1=CC(OC)=CC(OC)=C1)C1=CC=C(C=C1)O
MolPort-039-194-071 0.63 COc1ccc(cc1OC)C(=O)NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-6415291996 0.63 C12C(OC)=CC3=C(C(CC(=O)O3)C3C=CC4=C(OCCO4)C=3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-004-975-499 0.63 Clc1ccc(cc1)S(=O)(=O)NCC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-2208910145 0.63 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(C=2)OC(=O)C(C)(C)C)C1=O
MolPort-001-743-278 0.63 CN(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccc(c3)C(F)(F)F)c(=O)n1C2
MCULE-2511015992 0.63 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC=C(OC)C=3OCCC3=CC=CC=C3)C=21)=O)C1C=CC=CC=1
MolPort-002-518-176 0.63 COc1ccc(CNC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MCULE-8221211530 0.63 C12C(O)=CC(=CC=1OC1=C(C=CC=C1C)C2=O)OCC(=O)C1C=CC2C(=CC=CC=2)C=1
MolPort-002-518-339 0.63 COC(=O)[C@H](CCSC)NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-1827610396 0.63 C12C(O)=CC3=C(C(CC(=O)O3)C3C=C(OC)C(=C(OC)C=3)OC)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-039-193-934 0.63 COc1ccc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)cc1OCc1ccccc1
MCULE-1821596070 0.63 C1(=O)C2=CC(CC)=C(C=C2OC(C)=C1C1C=CC(=CC=1)F)OCC(OCC)=O
MolPort-019-556-076 0.63 CCOc1ccc(cc1)C(=O)CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-001-743-316 0.63 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(Cl)cc3)c(=O)n1C2
MolPort-039-036-700 0.63 O=c1cccc2[C@H]3C[C@H](CN(Cc4cc(no4)-c4ccncc4)C3)Cn12
MolPort-027-718-507 0.63 O=c1cccc2[C@H]3C[C@H](CN(Cc4nc5ccsc5c(=O)[nH]4)C3)Cn12
MolPort-001-744-284 0.63 Fc1ccc(CN2C[C@@H]3C[C@H](C2)c2c(ccc(=O)n2C3)-c2cncnc2)cc1
MolPort-005-910-829 0.63 OC(=O)C(N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1c[nH]c2cc(Cl)ccc12
MolPort-005-973-558 0.63 OC(=O)C(N1CC2CC(C1)c1cccc(=O)n1C2)c1c[nH]c2cc(Cl)ccc12
MolPort-002-720-628 0.63 CCOc1nc(NCC2CCCO2)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-000-767-050 0.63 COc1ccc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)cc1OCc1ccccc1
MolPort-035-873-893 0.63 CC(C)CCNC(=O)c1ccccc1NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-743-746 0.63 COc1ccc(CN2C[C@@H]3C[C@H](C2)c2ccc(-c4cncnc4)c(=O)n2C3)cc1
MolPort-001-743-705 0.63 Oc1ccccc1CN1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(OC(F)(F)F)cc3)c(=O)n1C2
MolPort-029-885-598 0.63 Cc1noc(C)c1CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-516-333 0.63 Cc1ccccc1C(=O)NC(NC(=S)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-044-478-624 0.63 Cc1n(C)nc2cc(NC(=O)N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)ccc12
MolPort-046-595-448 0.63 COc1cccc2[nH]c(cc12)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-046-598-051 0.63 COc1ccc(cc1OC)C(=O)NC(=S)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MolPort-046-597-263 0.63 O=c1cccc2[C@H]3C[C@H](CN(Cc4nc(no4)-c4ccccc4)C3)Cn12
MolPort-035-384-752 0.63 Cc1nn(CC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c(C)c1C
MolPort-044-181-269 0.63 COCCn1cc(C(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12
MolPort-044-181-265 0.63 CC(C)c1cccc2c(O)c(cnc12)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-106-851 0.63 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1cn2ccccc2n1
MolPort-044-181-248 0.63 COc1cc2cc([nH]c2cc1OC)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-700-906 0.63 Clc1cccc(CN2C(=O)N[C@@H](CCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)c1
MolPort-002-514-933 0.63 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccc2OCCOCCOCCOc2c1
MolPort-002-726-252 0.63 CCOc1nc(Nc2ccc(Cl)cc2)nc(n1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-194-063 0.63 Cc1ccccc1C(=O)NC(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-000-804-996 0.63 COc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2cccc3ccccc23)C1=O
MolPort-035-700-729 0.63 COc1ccc(CCN2C(=O)N[C@@H](CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)cc1OC
MolPort-001-743-504 0.63 CN(C)Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)C3CCCCC3)Cn2c1=O
MolPort-046-596-921 0.63 COc1cc2cc([nH]c2cc1OC)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-595-423 0.63 O=C(NCc1ccc2OCOc2c1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-046-423-864 0.63 COc1ccc(CC(=O)N2C[C@H]3C[C@@H](C2)c2ccc([N+]([O-])=O)c(=O)n2C3)cc1
MolPort-035-874-192 0.63 O=C([C@H](c1ccccc1)n1cnnn1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-596-536 0.63 CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2ccc(OCC(O)c3ccccc3)cc2)C1=O
MolPort-039-194-069 0.63 Clc1ccc(\C=C\C(=O)NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MolPort-044-432-027 0.63 Clc1cc(CCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)on1
MolPort-044-431-902 0.63 Cn1nc(cc1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2)C(C)(C)C
MolPort-002-509-589 0.63 COc1ccc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)c(OC)c1OC
MolPort-046-597-009 0.63 Clc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-020-232-155 0.63 O=c1cccc2[C@H]3C[C@H](CN(Cc4cc5CNCCn5n4)C3)Cn12
MolPort-009-745-155 0.63 Cc1cc(C(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c(C)o1
MolPort-004-931-169 0.63 Cc1c(O)ccc2c(CN3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc(=O)oc12
MolPort-044-478-596 0.63 O=C(Nc1cc(ccn1)C1CC1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-002-533-347 0.63 COc1cc2cc([nH]c2cc1OC)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-701-815 0.63 Clc1cc(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)on1
MolPort-029-884-949 0.63 CC(C)n1nnc(n1)-c1ccc(cc1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-002-525-504 0.63 Oc1cc(=O)[nH]c(SCC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)n1
MolPort-002-521-530 0.63 O=c1cccc2[C@H]3C[C@@H](CN(C3)C(=S)Nc3ccc4OCOc4c3)Cn12
MolPort-039-194-043 0.63 CN1C(=O)N(C)C(=O)C(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(OCC(O)c3ccccc3)cc2)C1=O
MolPort-004-831-607 0.63 Cc1ccc(cc1)C(=O)NC(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-001-743-455 0.63 CSc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)CN(C)C)Cn2c1=O
MolPort-002-511-552 0.63 COc1ccc(CC2(CN3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(CC=C)C2=O)cc1OC
MolPort-001-744-969 0.63 CN(C)CC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O
MolPort-007-923-118 0.63 Brc1ccccc1C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCCCCC1
MolPort-007-920-849 0.63 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCN(CC1)c1ccccc1
MolPort-007-921-186 0.63 CC1CC(C)CN(C1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(F)cc2)c1
MolPort-007-922-981 0.63 CC(C)(C)c1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccccc1F
MolPort-007-921-163 0.63 Fc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCC(Cc2ccccc2)CC1
MolPort-007-921-051 0.63 CN(Cc1ccccc1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(F)cc2)c1
MolPort-007-921-283 0.63 Fc1ccc(CNC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3ccc(F)cc3)c2)cc1
MolPort-007-921-207 0.63 Fc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)NC1CCN(Cc2ccccc2)CC1
MolPort-007-920-954 0.63 Fc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1cccc(c1)C(F)(F)F
MolPort-007-922-959 0.63 CN(Cc1ccccc1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccccc2Br)c1
MolPort-007-920-822 0.63 CC(=O)c1cccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(c2)[N+]([O-])=O)c1
MolPort-002-512-032 0.63 Brc1ccc(o1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-423-649 0.63 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)C3CN(C(=O)C3)c3ccccc3)Cn2c1=O
MolPort-039-056-753 0.63 O=C(C1CN(C(=O)C1)c1ccc2OCCOc2c1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-044-544-234 0.63 [O-][N+](=O)c1ccc2[C@@H]3C[C@H](CN(C3)C(=O)C3CN(C(=O)C3)c3ccccc3)Cn2c1=O
MolPort-029-895-440 0.62 O=c1cccc2[C@H]3C[C@@H](CN(C3)c3nccc(n3)-c3cccnc3)Cn12
MolPort-042-671-739 0.62 CC(C)Cc1cc(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n(C)n1
MCULE-2825534358 0.62 C1(=O)OC2=CC(=CC=C2C=C1C1C=CC(=CC=1)OC)OC(C)C(O)=O
MolPort-002-735-675 0.62 O=C(NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccco1
MolPort-035-700-693 0.62 CC(C)Cc1cc(C(=O)N2CC3CC(C2)c2cccc(=O)n2C3)n(C)n1
MCULE-7502997893 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=C(OC)C=3OCCC3C=CC4=C(CCO4)C=3)C=1OC=C(C1=CC=C(C=C1)Cl)C2=O
MolPort-001-743-530 0.62 O=C(N1C[C@@H]2C[C@H](C1)c1ccc(-c3cncnc3)c(=O)n1C2)c1ccncc1
MolPort-044-566-754 0.62 Cn1nnc(n1)-c1ccc(OCC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MCULE-4272669223 0.62 C1(=O)OC2=CC(=CC=C2C=C1C1=CC=C(C=C1)Cl)OCC(C1C=CC=CC=1)=O
MolPort-029-886-015 0.62 Clc1ccccc1CN1C(=O)N[C@@H](CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MolPort-046-106-593 0.62 O=c1cccc2[C@@H]3C[C@@H](CN(C3)S(=O)(=O)c3ccoc3)Cn12
MCULE-2506164674 0.62 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(OCC(OC(C)C)=O)C=2)C1=O
MolPort-046-106-777 0.62 Cc1nsc(C)c1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-027-718-824 0.62 COc1ccc(cc1)C(=O)Nc1cc(ccc1N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCc1ccccc1
MCULE-4494175226 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=C(O)C=3)C=1OC=C(C1=CC=CC=C1OC)C2=O
MolPort-029-885-078 0.62 Cn1nnc(n1)-c1ccc(OCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-028-856-942 0.62 Fc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(Cl)cc1
MCULE-6725237085 0.62 C1(C2=CC=CC=C2Cl)=COC2C(=CC=C(OCCCC)C=2)C1=O
MolPort-001-743-459 0.62 CSCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(SC)cc3)c(=O)n1C2
MolPort-046-751-933 0.62 Cc1cccc(CCN2CC3CNCC3(CCc3ccccc3)C2)n1
MCULE-2581673617 0.62 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OC(=O)C3=CC(OC)=C(C(OC)=C3)OC)C=2)CCC)C1=O
MolPort-039-194-075 0.62 O=C(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccco1
MolPort-044-563-950 0.62 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCN1CCOCC1
MCULE-9998944163 0.62 C12OC(C)(C)CCC1=C1C(=O)C3C4OC(C)(C)CCC=4C(O)=CC=3OC1=CC=2O
MolPort-001-744-926 0.62 O=C(N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc4ccccc4c3)c(=O)n1C2)c1cncnc1
MolPort-044-544-665 0.62 COc1ccc(CCNC(=O)[C@@H]2Cc3cc(ccc3N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@@H]23)[N+]([O-])=O)cc1OC
MCULE-2566596056 0.62 C1(C2C=CC3=C(OCCO3)C=2)=C(CC)OC2=C(C=C(C(OC(CC)=O)=C2)CC)C1=O
MolPort-046-068-049 0.62 Cc1cc(O)cc(=O)n1CCS(=O)(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-563-935 0.62 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCC1=CCCCC1
MCULE-8997413569 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=C(O)C=3)C=1OC=C(C1=CC=C(C=C1)Cl)C2=O
MolPort-001-743-713 0.62 CSc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(Cc4cnc5ccccc5c4)C3)Cn2c1=O
MolPort-044-562-601 0.62 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@H](Cn5c4cccc5=O)C3[C@@H](Cc2c1)C(=O)NCc1cccnc1
MCULE-8168364974 0.62 C1(C2C=CC(=CC=2)OC)=C(C)OC2C(=CC=C(OCC(=O)OC(C)(C)C)C=2)C1=O
MolPort-044-632-855 0.62 O=C(NCc1ccn(n1)C1CCCC1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-044-811-176 0.62 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCc1c[nH]cn1
MCULE-4858585113 0.62 C1(C2=CC=C(C(OC)=C2)OC)=COC2C(=CC=C(OCC(OC(C)C)=O)C=2)C1=O
MolPort-044-544-006 0.62 [O-][N+](=O)c1ccc2[C@H]3C[C@@H](CN(C3)C(=O)CCCc3nc4ccccc4c(=O)[nH]3)Cn2c1=O
MolPort-044-566-750 0.62 CC(C)Cn1nc(CC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2c1=O
MCULE-7093179122 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC4=C(OCCO4)C=3)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-001-743-765 0.62 Clc1ccc(\C=C\c2ccc3[C@@H]4C[C@@H](CN(Cc5cccc(c5)C#N)C4)Cn3c2=O)cc1
MolPort-027-876-824 0.62 CCN1CC(CC2(CCN(CCc3ccccn3)CC2)C1)c1ccccc1
MCULE-6950990798 0.62 C1(C2=CC=C(C=C2)Br)=COC2C(=CC=C(OC)C=2)C1=O
MolPort-044-565-318 0.62 CC(C)n1ccc2cc(ccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-027-718-592 0.62 Cc1noc(C)c1C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-6557975912 0.62 C1(C2=CC=C3C(OCCCO3)=C2)=COC2C(=CC=C(OC)C=2)C1=O
MolPort-007-921-052 0.62 COc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N(C)Cc1ccccc1
MolPort-027-809-865 0.62 Cc1ccc2nc(cn2c1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-4857847319 0.62 C1(C2=CC=CC=C2Cl)=C(C)OC2C(=CC(=C(OCC)C=2)CC)C1=O
MolPort-007-920-867 0.62 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(F)c(F)c1
MolPort-044-544-258 0.62 COc1cccc2c(O)c(cnc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-2983439538 0.62 C1(C2=CC=CC=C2F)=COC2C(=CC=C(OC(C)=O)C=2C)C1=O
MolPort-007-920-955 0.62 COc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1cccc(c1)C(F)(F)F
MolPort-044-478-818 0.62 CCc1cnc(CCNC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)s1
MCULE-1127161820 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(O)C=3)OC)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-044-544-311 0.62 Oc1c(cnc2ccc(OC(F)(F)F)cc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-566-757 0.62 Cn1nc(C(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2c1=O
MCULE-4065915374 0.62 C1(C2=CC=C(C(OC)=C2)OC)=COC2C(=CC=C(C=2)OC(C)C(OC)=O)C1=O
MolPort-001-743-480 0.62 Fc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccnc3)c(=O)n1C2
MolPort-044-479-566 0.62 COCc1cc(Cl)ccc1NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-8015657055 0.62 C1(C2=CC=CC=C2)=COC2C(=CC=C(OCC3C=CC=CC=3)C=2)C1=O
MolPort-044-478-818 0.62 CCc1cnc(CCNC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)s1
MolPort-044-230-887 0.62 O=C(Nc1ccc(cc1)-c1ncco1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-4063686975 0.62 C1(C2=CC=C(C(OC)=C2)OC)=C(C)OC2C(=CC=C(OCC(C3C=CC=CC=3)=O)C=2)C1=O
MolPort-044-230-887 0.62 O=C(Nc1ccc(cc1)-c1ncco1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-039-036-502 0.62 CC(Cc1ccccn1)N(C)CCC(=O)NC1CCCCCC1
MCULE-7704337220 0.62 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(OCC(OC)=O)C=2)C1=O
MolPort-044-181-282 0.62 COc1ccc2[nH]c(C(=O)NCCN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c(C)c2c1
MolPort-044-544-277 0.62 [O-][N+](=O)c1ccc2[C@H]3C[C@@H](CN(C3)C(=O)CCc3nc4ccccc4c(=O)[nH]3)Cn2c1=O
MCULE-2753317313 0.62 C1(C2=CC=CC=C2OC)=COC2C(=CC=C(OCC(OCCC)=O)C=2)C1=O
MolPort-001-743-447 0.62 CSc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O
MolPort-039-193-953 0.62 COc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccccc2OC)C1=O
MCULE-8928797324 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=CC=3OC)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-044-181-239 0.62 COc1cc2cc(C(=O)NCCN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)n(C)c2cc1OC
MolPort-046-768-586 0.62 Cl.Clc1ccc2Sc3ccccc3N(C(=O)CN3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1
MCULE-2118098159 0.62 C12OC=C(C(=O)C=1C=CC1OC(CC(C3C=CC=C(OC)C=3OCCC3=CC=CC=C3)C2=1)=O)C1=CC=C(C(OC)=C1)OC
MolPort-044-479-566 0.62 COCc1cc(Cl)ccc1NC(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-027-717-991 0.62 CN1C(=O)COc2ccc(cc12)C(=O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-4695279963 0.62 C12C(O)=CC3=C(C(C4=CC=C(C=C4)C(C)C)CC(=O)O3)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-044-181-237 0.62 COc1ccc2c3nccc4c5ccc(OCC(=O)N6C[C@H]7C[C@@H](C6)c6cccc(=O)n6C7)cc5n(c34)c(=O)c2c1OC
MolPort-030-082-536 0.62 [O-][N+](=O)c1cc(ccc1NCCc1ccc(Cl)cc1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-3225468965 0.62 C1(C2=CC=CC=C2)=C(C)OC2=C(C=CC(OC(C)C)=C2)C1=O
MolPort-002-516-226 0.62 ClC(Cl)(Cl)C(NC(=O)c1ccc(Br)cc1)NC(=S)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-029-886-532 0.62 O=C(COc1ccc2CCC(=O)Nc2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-6597657831 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3C=C(C(C)(C)C)C(=C(C(C)(C)C)C=3)O)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-044-544-258 0.62 COc1cccc2c(O)c(cnc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-744-015 0.62 CSc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)CN(C)C)c12
MCULE-8682909362 0.62 C1(C2=CC=CC=C2OC)=COC2C(=CC=C(C=2)OC(C)C(OCCCC)=O)C1=O
MolPort-044-544-277 0.62 [O-][N+](=O)c1ccc2[C@H]3C[C@@H](CN(C3)C(=O)CCc3nc4ccccc4c(=O)[nH]3)Cn2c1=O
MolPort-028-856-243 0.62 O=C(CCc1nc(no1)-c1ccncc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-7502468411 0.62 C1(C2C=CC(=CC=2)OC)=COC2=C(C=CC(OC(CCCCCN)=O)=C2)C1=O
MolPort-042-611-890 0.62 O=C(Cn1c(=S)[nH]c2ccccc2c1=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-046-423-480 0.62 CCOC(=O)Nc1ccc2n(C)c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)nc2c1
MCULE-5322539694 0.62 C1(C2=CC=CC=C2OC)=COC2C(=CC=C(OCC(OCC(C)C)=O)C=2)C1=O
MolPort-027-718-824 0.62 COc1ccc(cc1)C(=O)Nc1cc(ccc1N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCc1ccccc1
MolPort-028-596-777 0.62 C(Cc1ccccn1)N1CCC2(CC1)CC(CN(C2)C1CC1)c1ccccc1
MCULE-3735488252 0.62 C1(C2C=CC=CC=2OC)=C(C)OC2C(=CC=C(OCC(=O)C3C=CC(=CC=3)OC)C=2)C1=O
MolPort-009-759-216 0.62 OC(=O)c1nccnc1C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-423-675 0.62 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)CCc3nc4ccccc4c(=O)[nH]3)Cn2c1=O
MCULE-4735614342 0.62 C1(C2=CC=C3C(OCCCO3)=C2)=COC2C(=CC(=C(OCC(N)=O)C=2)CC)C1=O
MolPort-001-743-268 0.62 FC(F)(F)c1cccc(c1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O
MolPort-044-181-282 0.62 COc1ccc2[nH]c(C(=O)NCCN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c(C)c2c1
MCULE-8328335898 0.62 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(OC(CCC)=O)C=2)C1=O
MolPort-008-379-373 0.62 Cc1nnc(SCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)s1
MolPort-039-194-078 0.62 COc1cc(cc(OC)c1OC)C(=O)NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-3393827697 0.62 C12OC=C(C(=O)C=1C=CC1OC(CC(C3=CC=C(C=C3)O)C2=1)=O)C1C=CC(=CC=1)F
MolPort-039-346-382 0.62 O=C(CCc1nc(no1)-c1ccncc1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-044-181-237 0.62 COc1ccc2c3nccc4c5ccc(OCC(=O)N6C[C@H]7C[C@@H](C6)c6cccc(=O)n6C7)cc5n(c34)c(=O)c2c1OC
MCULE-4661951445 0.62 C1(=O)OC2=CC(=CC=C2C=C1C1C=CC(=CC=1)OC)OC(C(C)C)=O
MolPort-039-345-971 0.62 Cc1noc(C)c1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-046-597-344 0.62 COc1ccc(\C=N\NC(=O)CC#N)cc1CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-1562466831 0.62 C1(=O)OC2=CC(=CC=C2C=C1C1C=CC(=CC=1)OC)OC(CC)=O
MolPort-001-743-219 0.62 COc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O
MolPort-046-595-436 0.62 COc1ccc2c3nccc4c5ccc(OCC(=O)N6CC7CC(C6)c6cccc(=O)n6C7)cc5n(c34)c(=O)c2c1OC
MCULE-6554016804 0.62 C1(C2=CC=C3C(OCCO3)=C2)=C(C)OC2C(=CC(=C(OCC(N)=O)C=2)CCC)C1=O
MolPort-001-743-228 0.62 COc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)CCCC(O)=O)Cn2c1=O
MolPort-039-343-002 0.62 COc1cc(cc(OC)c1OC)C(=O)NC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-2337301025 0.62 C1(C2=CC=C3C(OCCO3)=C2)=COC2=C(C=C(C(OCC3=CC=C(C=C3)F)=C2)CC)C1=O
MolPort-027-809-865 0.62 Cc1ccc2nc(cn2c1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-345-971 0.62 Cc1noc(C)c1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-3201244730 0.62 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=C(OC)C(=C(OC)C=3)O)C=21)=O)C1C=CC=CC=1
MolPort-028-856-243 0.62 O=C(CCc1nc(no1)-c1ccncc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-181-239 0.62 COc1cc2cc(C(=O)NCCN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)n(C)c2cc1OC
MCULE-1736709501 0.62 C=CCOC(COC1=CC2=C(C(C(C3=CC=CC=C3)=CO2)=O)C=C1)=O
MolPort-001-743-862 0.62 COCCC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc(Cl)cc1
MolPort-035-881-866 0.62 ClC(Cl)(Cl)C(NC(=O)c1ccc(Br)cc1)NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-6820760499 0.62 C12OC=C(C(=O)C=1C=CC1OC(CC(C3C=CC=C(OC)C=3OCCC3=CC=C(C=C3)OC)C2=1)=O)C1=CC=C(C(OC)=C1)OC
MolPort-001-742-883 0.62 CC(C)(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)Nc3ccc(Cl)cc3)c(=O)n1C2
MolPort-042-611-890 0.62 O=C(Cn1c(=S)[nH]c2ccccc2c1=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-6981157375 0.62 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(C=2)OC(C2C=CC=CC=2)C(OCC)=O)C1=O
MolPort-001-743-481 0.62 O=C(N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccnc3)c(=O)n1C2)c1ccc(cc1)C#N
MolPort-030-000-435 0.62 OC1=NC(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(=O)N1CCc1ccccc1
MCULE-2050676092 0.62 C1(=O)C(C2C=CC3=C(OCCO3)C=2)=COC2C=C(OC(C)=O)C=C(OC(C)=O)C1=2
MolPort-039-343-002 0.62 COc1cc(cc(OC)c1OC)C(=O)NC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-346-382 0.62 O=C(CCc1nc(no1)-c1ccncc1)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-2704064036 0.62 C12OC=C(C(=O)C1=CC=C(O)C=2C(CC(OC)=O)C1C=CC2=C(OCCO2)C=1)C1=CC=C(C=C1)O
MolPort-015-162-563 0.62 O\N=C(/N1CC2CC(C1)c1cccc(=O)n1C2)c1cnc2ccccc2n1
MolPort-044-544-311 0.62 Oc1c(cnc2ccc(OC(F)(F)F)cc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-4081937731 0.62 C12C(O)=CC3=C(C(C4=CC=C(C=C4)C(OC)=O)CC(=O)O3)C=1OC=C(C1=CC=CC=C1)C2=O
MolPort-030-000-435 0.62 OC1=NC(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(=O)N1CCc1ccccc1
MolPort-044-810-715 0.62 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCc1cccnc1
MCULE-2994661077 0.62 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=C(OC)C4=C(OCCO4)C=3)C=21)=O)C1=CC=C(C=C1)O
MolPort-007-920-880 0.62 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCOCC1
MolPort-039-333-543 0.62 C(N1CCCC(C1)c1ccccn1)c1ccccc1
MCULE-4375568550 0.62 C1(C2=CC=C(C=C2)Br)=C(C)OC2C(=CC=C(OCC(=O)C3C=CC(=CC=3)F)C=2)C1=O
MolPort-007-921-034 0.62 C=CCN(C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccncc2)c1)c1ccccc1
MolPort-042-567-621 0.62 O=C(NCCc1cccc(=O)[nH]1)C1CC11CC1
MCULE-8990388805 0.62 C12=C(C=C(C3CC(C)OC1=3)C)OC(C(C)=C2C)=O
MolPort-007-931-087 0.62 CCc1ccc(NC(=O)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCC=C)cc1
MolPort-007-922-587 0.62 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)NCc1ccc(Cl)cc1
MCULE-1026747709 0.62 [Cl-].C1(C[NH+](C)C)=C(O)C(CCC)=CC2C(C(C3C=CC4=C(OCCO4)C=3)=COC=21)=O
MolPort-019-898-109 0.62 COc1ccccc1-c1ccc(nn1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-007-922-769 0.62 COc1cc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(N)c2)cc(OC)c1OC
MCULE-1770634303 0.62 C1(C2=CC=C(C(OC)=C2)OC)=CC2=CC=C(C=C2OC1=O)OCC(C1C=CC=CC=1)=O
MolPort-001-744-463 0.62 CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NS(=O)(=O)c3ccccc3)c(=O)n1C2
MolPort-007-922-986 0.62 Fc1ccccc1NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2c(F)cccc2F)c1
MCULE-4149271819 0.62 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(OCC(=O)NC(CO)C3C=CC=CC=3)C=2)C1=O
MolPort-044-566-757 0.62 Cn1nc(C(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2c1=O
MolPort-001-742-963 0.62 O=C(NC1CCCCC1)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)c3ccncc3)c(=O)n1C2
MCULE-4813707576 0.62 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=C(OC)C(=C(OC)C=3)OC)C=21)=O)C1=CC=C(C=C1)O
MolPort-016-586-247 0.62 [O-][N+](=O)c1cc2OCOc2cc1CN1CC2CC(C1)c1cccc(=O)n1C2
MolPort-007-932-548 0.62 Cc1ccc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)N2CCCC2)cc1C
MCULE-3006194214 0.62 C1(C2C=CC3=C(OCCO3)C=2)=C(C)OC2=C(C=C(C(OC(C)=O)=C2)CC)C1=O
MolPort-008-347-642 0.62 CCOC(=O)Nc1ccc2n(C)c(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)nc2c1
MolPort-039-055-603 0.62 Clc1ccc2[nH]c3c(ncnc3c2c1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-6884255481 0.62 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC(=C(OC(=O)C3C(=CC=CC=3OC)OC)C=2)CCCCCC)C1=O
MolPort-039-194-078 0.62 COc1cc(cc(OC)c1OC)C(=O)NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-007-932-527 0.62 Cc1ccc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NC2CCCC2)cc1
MCULE-6625227157 0.62 C1(=COC2=C(C=C(C(OC(C)=O)=C2)CC)C1=O)C1=CC2=C(C=CC=C2)O1
MolPort-001-744-262 0.62 CSc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(Cc4ccc(F)cc4)C3)c12
MolPort-007-922-569 0.62 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(Cl)cc1
MCULE-7973631443 0.62 C1(=C(C)OC2=C(C=C(C(O)=C2)CC)C1=O)C1=C(C)C=C2C(OCCO2)=C1
MolPort-001-744-268 0.62 CSc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C3CCOCC3)c12
MolPort-046-424-121 0.62 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H](C3C(Cc2c1)C(=O)NCC1CCCO1)c1cccc(=O)n1C4
MCULE-7390082276 0.62 C1(C2C=CC(=CC=2Cl)Cl)=COC2C(=CC=C(OC(CCC3C=CC=CC=3)=O)C=2)C1=O
MolPort-044-566-750 0.62 CC(C)Cn1nc(CC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2c1=O
MolPort-007-932-444 0.62 Cc1ccc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)N2CCCC2)cc1
MCULE-6592854240 0.62 C1(=O)C2=CC=C(C(C)=C2OC(C)=C1C1=CC=C(C=C1)OC)OCCBr
MolPort-002-513-549 0.62 Oc1c(ccc2C(=O)c3ccccc3C(=O)c12)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-007-932-439 0.62 Cc1ccc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NC2CCCCC2)cc1
MCULE-3235415029 0.62 C1(C2=CC=C(C=C2)Cl)=COC2C(=CC=C(OCC)C=2)C1=O
MolPort-006-805-955 0.62 [O-][S+]1(=O)CCC(C1)NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-007-920-872 0.62 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccccc1F
MCULE-1079395709 0.62 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OC(=O)N(C)C)C=2)CCC)C1=O
MolPort-002-519-363 0.62 O=C(Nc1ccc2OCCOc2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-007-929-083 0.62 CCc1ccc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCc2ccccc2)cc1
MCULE-5293317218 0.62 C1(C2=CC=C3C(OCCO3)=C2)=C(C)OC2C(=CC(=C(OCC3=CC=CC(OC)=C3)C=2)CCC)C1=O
MolPort-046-595-436 0.62 COc1ccc2c3nccc4c5ccc(OCC(=O)N6CC7CC(C6)c6cccc(=O)n6C7)cc5n(c34)c(=O)c2c1OC
MolPort-046-681-957 0.62 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H]([C@@H]3[C@@H](Cc2c1)C(=O)NCC1CCCO1)c1cccc(=O)n1C4
MCULE-2717995815 0.62 C1(=C(C)OC2=C(C=C(C(OC(C)=O)=C2)CC)C1=O)C1=C(C)C=C2C(OCCO2)=C1
MolPort-035-881-866 0.62 ClC(Cl)(Cl)C(NC(=O)c1ccc(Br)cc1)NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-046-424-121 0.62 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H](C3C(Cc2c1)C(=O)NCC1CCCO1)c1cccc(=O)n1C4
MCULE-6980485156 0.62 C1(C2=CC=C(C(OC)=C2)OC)=COC2C(=CC=C(OCC(O)=O)C=2)C1=O
MolPort-001-745-163 0.62 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(NC(=O)Nc3ccc(Cl)cc3)ccc(=O)n1C2
MolPort-007-932-544 0.62 Cc1ccc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NC2CCCC2)cc1C
MCULE-7803039492 0.62 C1(C2=CC=C3C(OCCO3)=C2)=C(C)OC2=C(C=C(C(O)=C2)CC)C1=O
MolPort-001-744-345 0.62 Fc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccccc1
MolPort-001-743-629 0.62 CC(=O)Nc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)NC3CCCCC3)Cn2c1=O
MCULE-4598422437 0.62 C1(=O)C(C2=CC=C3C(OCCCO3)=C2)=COC2C=C(O)C=C(O)C1=2
MolPort-001-743-574 0.62 O=C(N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccc(c3)C#N)c(=O)n1C2)c1ccccc1
MolPort-035-873-980 0.62 COc1ccc(cc1)N1C(=O)N[C@@H](CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MCULE-5395584038 0.62 C1(C2C=CC3=C(OCCCO3)C=2)=C(C)OC2=C(C=C(C(OC(C)=O)=C2)CCC)C1=O
MolPort-005-910-167 0.62 O=c1cccc2[C@@H]3C[C@@H](CN(C3)C(=S)Nc3cccc4nonc34)Cn12
MolPort-007-931-627 0.62 CCC(C)NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=S)Nc2cc(C)cc(C)c2)c1
MCULE-5614119005 0.62 C1(C2C=CC(=CC=2)OC)=COC2C(=CC=C(OCCN3CCCCC3)C=2C)C1=O
MolPort-046-423-480 0.62 CCOC(=O)Nc1ccc2n(C)c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)nc2c1
MolPort-007-931-014 0.62 CCc1ccc(NC(=O)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCc2ccc(C)cc2)cc1
MCULE-5937690319 0.62 C1(C2C=CC3=C(OCO3)C=2)=COC2=C(C=C(C(OC)=C2)CC)C1=O
MolPort-046-423-675 0.62 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)CCc3nc4ccccc4c(=O)[nH]3)Cn2c1=O
MolPort-044-544-583 0.62 COc1ccc(cc1)N1C(=O)N[C@@H](CC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MCULE-6793373622 0.62 C1(C2C=CC(=CC=2)OC)=COC2C(=CC=C(OCCN3CCC(CC3)C)C=2C)C1=O
MolPort-000-746-626 0.62 [O-][N+](=O)c1cccc(c1)S(=O)(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-000-770-706 0.62 CCCCCc1c(O)nc(SCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)nc1O
MCULE-1982601976 0.62 C1(C2C=CC(=CC=2)OC)=C(C)OC2C(=CC=C(OCC(O)=O)C=2)C1=O
MolPort-001-743-833 0.62 O=C(N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc2ccccc2c1)c1ccc(cc1)C#N
MolPort-007-920-871 0.62 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)NCCc1ccc(Cl)cc1
MCULE-5732957951 0.62 C12OC=C(C(=O)C1=CC=C(O)C=2C(CC(OC)=O)C1C=CC=C(C=1)OCC(OC)=O)C1=CC=C(C=C1)O
MolPort-000-692-315 0.62 FC(F)(F)C1(NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)Oc2ccccc2O1
MolPort-007-922-961 0.62 CN(Cc1ccccc1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccccc2Cl)c1
MCULE-6896647748 0.62 C12C(CCC(OC=O)(C)C)=C(OC)C(O)=CC=1OC1C=C3OC(C)(C)CCC3=C(O)C=1C2=O
MolPort-027-717-991 0.62 CN1C(=O)COc2ccc(cc12)C(=O)CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-007-922-966 0.62 CCC(C)NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2c(F)cccc2F)c1
MCULE-2149646988 0.62 C1(CN(C)C)=C(O)C(CCC)=CC2C(C(C3C=CC4=C(OCCO4)C=3)=COC=21)=O
MolPort-001-743-865 0.62 OC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc(Cl)cc1
MolPort-007-932-536 0.62 Cc1ccc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NC2CCCCC2)cc1C
MCULE-1276436153 0.62 C1(C2=CC=C(C=C2)Cl)=COC2C(=CC=C(OCC(O)=O)C=2)C1=O
MolPort-002-517-716 0.62 CSCC[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(cc1)C(C)C
MolPort-005-979-354 0.62 COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-1690003761 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3C=C(F)C(=C(F)C=3)F)C=1OC=C(C1=CC=CC=C1)C2=O
MolPort-001-744-128 0.62 OC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cccc(c1)C#N
MolPort-005-910-191 0.62 COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MCULE-5674348958 0.62 C1(C2=CC=CC=C2OC)=COC2C(=CC=C(OCC(OCCCCC)=O)C=2)C1=O
MolPort-001-742-856 0.62 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O)c1ccc(cc1)-c1ccccc1
MolPort-009-745-162 0.62 Cc1cc(no1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-3262890779 0.62 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(OC(C)=O)C=2)C1=O
MolPort-000-782-345 0.62 COc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccccc2OC)C1=O
MolPort-019-558-393 0.62 O=C1N(CCCSC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)c2ccccc12
MCULE-8201092793 0.62 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(C=2)OC(C)C(OCC)=O)C1=O
MolPort-019-558-364 0.62 CCc1cccc(C)c1NC(=O)C(C)SC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-029-885-559 0.62 Clc1ccccc1CN1C(=O)N[C@@H](CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MCULE-3912452941 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=C(OC)C=3OCCC3=CC=C(C=C3)OC)C=1OC=C(C1=CC=C(C=C1)Cl)C2=O
MolPort-002-518-798 0.62 COc1ccc(NC(=O)[C@@H](NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(C)C)cc1OC
MolPort-005-105-829 0.62 O=c1cccc2[C@H]3C[C@H](CN(Cc4nc(Cc5ccccc5)no4)C3)Cn12
MCULE-2446611480 0.62 C12C(CCC(O)(C)C)=C(OC)C(O)=CC=1OC1C=C3OC(C)(C)CCC3=C(O)C=1C2=O
MolPort-001-744-383 0.62 Fc1ccc(cc1)C(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccc4ccccc4c3)Cn2c1=O
MolPort-046-681-957 0.62 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H]([C@@H]3[C@@H](Cc2c1)C(=O)NCC1CCCO1)c1cccc(=O)n1C4
MCULE-6909508464 0.62 C1(C(F)(F)F)OC2C=C(OC(C)C)C(=CC=2C(=O)C=1C1=CC=C2C(OCCO2)=C1)CCC
MolPort-019-558-359 0.62 CC(SC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1cc(C)ccc1C
MolPort-004-831-621 0.62 CC1(C)C(C=C(Cl)Cl)C1C(=O)NC(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MCULE-4403418176 0.62 C12OC(C)(CO)C=CC=1C(O)=C1C(=O)C(C3C=CC(O)=CC=3)=COC1=C2
MolPort-029-886-532 0.62 O=C(COc1ccc2CCC(=O)Nc2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-055-603 0.62 Clc1ccc2[nH]c3c(ncnc3c2c1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-1846511061 0.62 C12OC=C(C(=O)C1=CC=C1OC(CC(C3=CC=C(C(O)=C3)OC)C=21)=O)C1C=CC(=CC=1)O
MolPort-019-556-081 0.62 O=C(CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)Nc1cnc2ccccc2c1
MolPort-042-646-414 0.62 Cc1cc(=O)oc2c(C)c(O)c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc12
MCULE-9975045031 0.62 C1(=O)C(C2C=CC(=CC=2)OCC2=CC=C(C=C2)Br)=COC2=CC(OCC3=CC=C(C=C3)Br)=CC(OCC3C=CC(=CC=3)Br)=C12
MolPort-001-744-131 0.62 O=C(NC1CCCCC1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cccc(c1)C#N
MolPort-044-564-847 0.62 Cn1ccc2cc(ccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MCULE-9986879413 0.62 C12OC=C(C(=O)C1=CC=C(OC)C=2C(CC(OC)=O)C1C=CC2=C(OCCO2)C=1)C1=CC=C(C=C1)OC
MolPort-030-082-536 0.62 [O-][N+](=O)c1cc(ccc1NCCc1ccc(Cl)cc1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-029-886-015 0.62 Clc1ccccc1CN1C(=O)N[C@@H](CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MCULE-6739897648 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=CC=3OC)OC)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-007-922-571 0.62 [O-][N+](=O)c1cc(ccc1NCc1ccc(Cl)cc1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-029-885-078 0.62 Cn1nnc(n1)-c1ccc(OCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MCULE-9242952327 0.62 C1(C2=CC=CC=C2OC)=COC2C(=CC=C(OCC(OCCC(C)C)=O)C=2)C1=O
MolPort-001-743-136 0.62 CC(C)(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)COc3ccccc3)c(=O)n1C2
MolPort-044-544-006 0.62 [O-][N+](=O)c1ccc2[C@H]3C[C@@H](CN(C3)C(=O)CCCc3nc4ccccc4c(=O)[nH]3)Cn2c1=O
MCULE-3536161018 0.62 C1(C2C=CC(=CC=2)OC)=C(C)OC2C(=CC=C(OCC)C=2)C1=O
MolPort-002-519-260 0.62 CCc1ccc(NC(=O)[C@H](CCSC)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-039-194-075 0.62 O=C(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccco1
MCULE-7843302561 0.62 C1(O)C(C/C=C(\C)/C)=C2OC=C(C3C=CC(OC)=CC=3)C(=O)C2=C(O)C=1
MolPort-019-595-759 0.62 CCOc1ccc(NC(=O)CSC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-039-194-136 0.62 O=C(\C=C\c1ccc2OCOc2c1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-5329894018 0.62 C1(C2=CC=C(C=C2)Cl)=COC2C(=CC(=C(OC(=O)C3C=CC(=CC=3)C3C=CC=CC=3)C=2)CCCCCC)C1=O
MolPort-002-519-256 0.62 COc1cc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C2=O)c2ccccc2)ccc1O
MolPort-028-854-762 0.62 Cc1nc2ccc(F)cc2c(=O)n1CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-8573588296 0.62 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC(=C(OC(=O)C3=C(C)C=C(C=C3C)C)C=2)CCCCCC)C1=O
MolPort-039-193-953 0.62 COc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccccc2OC)C1=O
MolPort-029-895-440 0.62 O=c1cccc2[C@H]3C[C@@H](CN(C3)c3nccc(n3)-c3cccnc3)Cn12
MCULE-4259772100 0.62 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OCC3=CC(=O)OC4C=C(OC)C=CC=43)C=2)CCC)C1=O
MolPort-046-768-586 0.62 Cl.Clc1ccc2Sc3ccccc3N(C(=O)CN3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-044-632-855 0.62 O=C(NCc1ccn(n1)C1CCCC1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-7905758613 0.62 C1(C2=CC=C(C=C2)Cl)=COC2C(=CC(=C(OC(=O)C3=CC=CC(C)=C3)C=2)CCCCCC)C1=O
MolPort-019-599-617 0.62 Fc1ccccc1N1CCN(CC1)C(=O)CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-346-786 0.62 Cn1nnc(n1)-c1ccc(OCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MCULE-6185141513 0.62 C1(C2=CC=CC=C2F)=COC2=C(C=CC(OC(C)C)=C2)C1=O
MolPort-019-603-802 0.62 Cc1ccc(F)cc1NC(=O)CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-044-565-318 0.62 CC(C)n1ccc2cc(ccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MCULE-2366991347 0.62 C1(C2=CC=CC=C2)=COC2C(=CC=C(OCC3=CC=CC4=CC=CC=C34)C=2)C1=O
MolPort-002-517-619 0.62 CC(C)[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(OCc2ccccc2)cc1
MolPort-046-596-995 0.62 COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-9847171716 0.62 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC4=C(OCCO4)C=3)C=21)=O)C1C=CC(=CC=1)O
MolPort-001-742-860 0.62 COCCC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O
MolPort-030-042-364 0.62 COC(=O)c1ccccc1NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-001-744-175 0.62 COCCC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc(NC(C)=O)cc1
MolPort-027-564-272 0.62 COC(=O)c1ccccc1NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-743-871 0.62 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc(Cl)cc1
MolPort-035-873-947 0.62 Cn1nc(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2c1=O
MolPort-001-744-404 0.62 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccc(cc3)-c3ccccc3)Cn2c1=O)c1ccccc1
MolPort-029-886-050 0.62 COc1ccc(CN2C(=O)N[C@@H](CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)cc1
MolPort-027-718-592 0.62 Cc1noc(C)c1C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-424-161 0.62 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)CCCc3nc4ccccc4c(=O)[nH]3)Cn2c1=O
MolPort-005-976-395 0.62 O=c1cccc2C3CC(CN(C3)C(=S)Nc3cccc4nonc34)Cn12
MolPort-046-768-582 0.62 Fc1cc(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2OCOCc2c1
MolPort-001-744-762 0.62 O=c1c(ccc2[C@@H]3C[C@@H](CN(CCCc4ccccc4)C3)Cn12)-c1ccccc1CN1CCOCC1
MolPort-044-544-583 0.62 COc1ccc(cc1)N1C(=O)N[C@@H](CC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MolPort-028-596-777 0.62 C(Cc1ccccn1)N1CCC2(CC1)CC(CN(C2)C1CC1)c1ccccc1
MolPort-035-873-980 0.62 COc1ccc(cc1)N1C(=O)N[C@@H](CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MolPort-000-784-885 0.62 ClC(Cl)(Cl)C(NC(=O)c1ccc(Br)cc1)NC(=S)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-044-431-328 0.62 CC(C)n1ccc2cc(ccc12)C(=O)N1C[C@@H]2CC(C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-000-794-062 0.62 COc1ccc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(Cc3ccccc3)C2=O)c(OC)c1
MolPort-044-431-316 0.62 Cn1ccc2cc(ccc12)C(=O)N1C[C@@H]2CC(C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-001-743-810 0.62 COCCC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc(OC)cc1
MolPort-027-718-031 0.62 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCN(CC1)c1ccccc1
MolPort-001-743-160 0.62 CC(C)NC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O
MolPort-046-068-049 0.62 Cc1cc(O)cc(=O)n1CCS(=O)(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-743-763 0.62 COc1ccc(CN2C[C@@H]3C[C@H](C2)c2ccc(\C=C\c4ccc(Cl)cc4)c(=O)n2C3)cc1
MolPort-044-466-160 0.62 FC(F)Oc1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1F
MolPort-002-737-009 0.62 Clc1ccc(cn1)C(=O)NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-180-474 0.62 CC(C)n1ccc2cc(ccc12)C(=O)N1C[C@@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-001-743-161 0.62 O=C(Nc1ccccc1)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O
MolPort-046-106-777 0.62 Cc1nsc(C)c1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-046-597-344 0.62 COc1ccc(\C=N\NC(=O)CC#N)cc1CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-180-391 0.62 Cn1ccc2cc(ccc12)C(=O)N1C[C@@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-002-770-160 0.62 Clc1ccc(cn1)C(=O)NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-044-432-054 0.62 Cn1nc(C(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c2ccccc2c1=O
MolPort-001-744-945 0.62 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccn3)Cn2c1=O)C1CCCCC1
MolPort-003-023-763 0.62 O=C(Nc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2)C1CCCCC1
MolPort-003-023-766 0.62 O=C(CCC1CCCCC1)Nc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-003-023-767 0.62 O=C(Nc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2)C12CC3CC(CC(C3)C1)C2
MolPort-003-023-764 0.62 O=C(CC1CCCCC1)Nc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-003-023-765 0.62 O=C(CCC1CCCC1)Nc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-036-502 0.62 CC(Cc1ccccn1)N(C)CCC(=O)NC1CCCCCC1
MolPort-039-333-543 0.62 C(N1CCCC(C1)c1ccccn1)c1ccccc1
MolPort-003-586-966 0.62 CC(C)CC(=O)Nc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-000-801-833 0.62 CCc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccccc2OC)C1=O
MolPort-007-921-161 0.62 Fc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCN(Cc2ccccc2)CC1
MolPort-001-743-150 0.62 O=C(NC1CCCCC1)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)c3ccccc3)c(=O)n1C2
MolPort-007-920-837 0.62 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N(CC=C)c1ccccc1
MolPort-002-516-357 0.62 Clc1ccc(cc1)C(=O)NC(NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-046-106-593 0.62 O=c1cccc2[C@@H]3C[C@@H](CN(C3)S(=O)(=O)c3ccoc3)Cn12
MolPort-002-521-700 0.62 O=c1cccc2[C@H]3C[C@@H](CN(C3)C(=S)Nc3ccc4OCCOc4c3)Cn12
MolPort-001-744-211 0.62 COc1ccc(CN2C[C@@H]3C[C@H](C2)c2c(ccc(=O)n2C3)-c2ccc(Cl)cc2)cc1
MolPort-002-518-906 0.62 CSCC[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)NCc1ccc(C)cc1
MolPort-039-193-979 0.62 COc1c(Br)cc(Br)cc1CC1(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)C(=O)N(C)C(=S)N(C)C1=O
MolPort-001-743-715 0.62 CSc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(Cc4ccccc4O)C3)Cn2c1=O
MolPort-046-596-908 0.62 COc1ccc2[nH]c(C(=O)N3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)c(C)c2c1
MolPort-009-745-152 0.62 O=C(N1CC2CC(C1)c1cccc(=O)n1C2)c1cc(=O)c2ccccc2o1
MolPort-001-743-280 0.62 COCCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccc(c3)C(F)(F)F)c(=O)n1C2
MolPort-005-910-798 0.62 OC(=O)C(N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)c1c[nH]c2cc(Br)ccc12
MolPort-044-431-285 0.62 Cc1ccc(C(O)=O)c(NC(=O)N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MolPort-044-430-883 0.62 O=C(NCC1COc2ccccc2O1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-042-671-739 0.62 CC(C)Cc1cc(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n(C)n1
MolPort-000-757-846 0.62 CCC(C)c1c(O)nc(SCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)nc1O
MolPort-000-763-717 0.62 CC(C)Cc1c(O)nc(SCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)nc1O
MolPort-035-873-762 0.62 CC(C)Cn1nc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2c1=O
MolPort-001-743-718 0.62 O=c1c(ccc2[C@@H]3C[C@@H](CN(Cc4cccs4)C3)Cn12)-c1cccnc1
MolPort-001-743-714 0.62 CSc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(Cc4cccc(c4)C#N)C3)Cn2c1=O
MolPort-001-744-257 0.62 Oc1ccccc1CN1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc(OC(F)(F)F)cc1
MolPort-001-743-934 0.62 Fc1ccccc1-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)c3ccccc3)c12
MolPort-001-743-700 0.62 Fc1ccc(CN2C[C@@H]3C[C@H](C2)c2ccc(-c4ccc(OC(F)(F)F)cc4)c(=O)n2C3)cc1
MolPort-044-543-477 0.62 Cc1nc(C)c(o1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-743-589 0.62 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccc(c3)C#N)c(=O)n1C2
MolPort-027-718-787 0.62 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCSCC1
MolPort-001-743-310 0.62 OC(=O)CCCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(Cl)cc3)c(=O)n1C2
MolPort-044-544-619 0.62 Oc1c(cnc2cc(Cl)ccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-744-469 0.62 CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)Nc3cccc(F)c3)c(=O)n1C2
MolPort-007-932-550 0.62 Cc1ccc(CNC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=S)Nc3ccc(C)c(C)c3)c2)cc1
MolPort-007-931-931 0.62 CN(Cc1ccccc1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=S)Nc2cc(C)cc(C)c2)c1
MolPort-007-931-933 0.62 Cc1cc(C)cc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCc2ccccc2)c1
MolPort-007-931-653 0.62 CC1CC(C)CN(C1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=S)Nc2cc(C)cc(C)c2)c1
MolPort-007-931-652 0.62 Cc1cc(C)cc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NC2CC2)c1
MolPort-007-931-649 0.62 CC1CCN(CC1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=S)Nc2cc(C)cc(C)c2)c1
MolPort-001-745-008 0.62 Fc1cccc(c1)S(=O)(=O)Nc1ccc2[C@@H]3C[C@@H](CN(CC4CCCCC4)C3)Cn2c1=O
MolPort-007-931-647 0.62 CC(C)CCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=S)Nc2cc(C)cc(C)c2)c1
MolPort-009-745-121 0.62 O=C(N1CC2CC(C1)c1cccc(=O)n1C2)c1cccc(c1)-n1cnnn1
MolPort-001-744-062 0.62 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cncnc1
MolPort-046-595-440 0.62 O=C(NCC1COc2ccccc2O1)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-515-615 0.62 Cc1cc(oc1C)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-007-932-913 0.62 Clc1ccccc1CNC(=O)c1ccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-002-531-625 0.62 COc1ccc2[nH]c(C(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c(C)c2c1
MolPort-039-057-564 0.62 O=C(Cn1nnc2ccccc2c1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-743-305 0.62 Clc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccncc3)Cn2c1=O
MolPort-001-743-457 0.62 COCCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(SC)cc3)c(=O)n1C2
MolPort-007-921-188 0.62 COc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CC(C)CC(C)C1
MolPort-035-874-123 0.62 O=C(Cn1ccc2c(cnc3ccnn23)c1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-007-921-115 0.62 CCOc1ccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3ccc(OC)cc3)c2)cc1
MolPort-044-431-950 0.62 O=C(Cn1ccc2c(cnc3ccnn23)c1=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-525-453 0.62 Cc1ccc2n(C)c3c(ncnc3c2c1)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-001-744-347 0.62 O=C(N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccccc1)c1ccc(cc1)C#N
MolPort-007-921-165 0.62 COc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCC(Cc2ccccc2)CC1
MolPort-035-700-693 0.62 CC(C)Cc1cc(C(=O)N2CC3CC(C2)c2cccc(=O)n2C3)n(C)n1
MolPort-007-921-174 0.62 Fc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCC(=O)CC1
MolPort-046-482-369 0.62 Cc1nnsc1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-007-921-255 0.62 COc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCCC(C)C1
MolPort-001-743-234 0.62 COc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)NC(C)C)Cn2c1=O
MolPort-007-921-209 0.62 COc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)NC1CCN(Cc2ccccc2)CC1
MolPort-044-566-754 0.62 Cn1nnc(n1)-c1ccc(OCC(=O)NCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-007-922-580 0.62 [O-][N+](=O)c1cc(ccc1NCc1ccc(F)cc1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-001-743-501 0.62 CN(C)Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O
MolPort-028-856-942 0.62 Fc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(Cl)cc1
MolPort-007-922-860 0.62 CCOc1ccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3ccc(cc3)C(C)(C)C)c2)cc1
MolPort-007-931-642 0.62 Cc1cc(C)cc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCCc2ccccc2)c1
MolPort-002-518-238 0.62 COc1cccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1
MolPort-001-742-869 0.62 CC(C)(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)c3ccc(cc3)C#N)c(=O)n1C2
MolPort-000-779-959 0.62 CCOc1ccc(CC2(CN3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C2=O)c2ccc(OC)cc2)cc1
MolPort-001-743-631 0.62 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(NC(C)=O)cc3)c(=O)n1C2
MolPort-001-742-895 0.62 CC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)COc3ccccc3)Cn2c1=O
MolPort-001-743-227 0.62 COc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)CCC(O)=O)Cn2c1=O
MolPort-001-743-106 0.62 COc1ccc(cc1)C(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C3CCN(CC3)C(C)=O)Cn2c1=O
MolPort-001-743-231 0.62 COc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)NC3CCCCC3)Cn2c1=O
MolPort-001-744-381 0.62 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccc4ccccc4c3)Cn2c1=O)c1ccc(cc1)C#N
MolPort-001-744-338 0.62 CC(=O)Nc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C3CCOCC3)c12
MolPort-001-744-335 0.62 CC(=O)Nc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(Cc4cccc(c4)C#N)C3)c12
MolPort-001-744-330 0.62 CC(=O)Nc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(Cc4cnc5ccccc5c4)C3)c12
MolPort-001-744-311 0.62 Clc1ccc(\C=C\c2ccc(=O)n3C[C@H]4C[C@H](CN(Cc5cccc(c5)C#N)C4)c23)cc1
MCULE-8795961934 0.62 C1(=COC2=C(C=CC=C2)C1=O)C(CC(OC)=O)C1C(OC)=CC=C2C(C(C3=CC=C(C=C3)OC)=COC=12)=O
MolPort-001-744-642 0.62 Fc1ccc(CN2C[C@@H]3C[C@H](C2)c2ccc(NC(=O)c4ccncc4)c(=O)n2C3)cc1
MolPort-001-744-309 0.62 Clc1ccc(\C=C\c2ccc(=O)n3C[C@H]4C[C@H](CN(Cc5cnc6ccccc6c5)C4)c23)cc1
MCULE-8701546074 0.62 C12C(O)=CC3=C(C(C4=CC=C(C=C4)C(OC)=O)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-001-744-328 0.62 CC(=O)Nc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(Cc4ccc(F)cc4)C3)c12
MolPort-001-993-546 0.62 O=C(NC12CC3CC(CC(C3)C1)C2)N1CC2CC(C1)n1c(C2)cccc1=O
MCULE-4087154819 0.62 C1(C2=CC=C(C=C2)OC)=COC2C(=CC(=C(OC)C=2)O)C1=O
MolPort-001-743-463 0.62 CSc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)NC3CCCCC3)Cn2c1=O
MolPort-044-811-176 0.62 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCc1c[nH]cn1
MCULE-8835183061 0.62 C12OC=C(C(=O)C1=CC=C(O)C=2C(CC(OC)=O)C1C=CC=C2C=CC=CC=12)C1=CC=C(C=C1)O
MolPort-001-743-587 0.62 O=C(NC1CCCCC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccc(c3)C#N)c(=O)n1C2
MolPort-044-810-878 0.62 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCc1ccccn1
MCULE-6368892025 0.62 C12OC=C(C(=O)C=1C=CC1OC(CC(C3C=C(C(C)(C)C)C(=C(C(C)(C)C)C=3)O)C2=1)=O)C1C=CC(=CC=1)F
MolPort-007-922-960 0.62 CN(Cc1ccccc1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2c(F)cccc2F)c1
MolPort-044-543-843 0.62 COc1ccc(CNC(=O)[C@@H]2Cc3cc(ccc3N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@@H]23)[N+]([O-])=O)cc1
MCULE-7156413895 0.62 C12=C(C)C3OC(C)(C)CCC=3C=C1C1=C(C=CC=C1)C(=O)O2
MolPort-005-946-334 0.62 CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)c3ccc(cc3)-c3ccccc3)c(=O)n1C2
MolPort-007-931-935 0.62 Cc1cc(C)cc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)N2CCCC2)c1
MCULE-4019565408 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3C=C(F)C(=C(F)C=3)F)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-005-946-370 0.62 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(NC(=O)c3ccc(cc3)C#N)ccc(=O)n1C2
MolPort-007-931-930 0.62 Cc1cc(C)cc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)N2CCCCCC2)c1
MCULE-8615442519 0.62 C12OC=C(C3=CC=C(OC)C=C3)C(=O)C1=C(OC)C(OC)=C(OC)C=2
MolPort-007-922-849 0.62 COCCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(cc2)C(C)(C)C)c1
MolPort-007-931-645 0.62 Cc1cc(C)cc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NC2CCCC2)c1
MCULE-9707126005 0.62 C1(C2C=CC=CC=2)=COC2C(=CC=C(OCC3C=CC(=CC=3)C)C=2)C1=O
MolPort-003-023-759 0.62 CC(C)C(=O)Nc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-001-743-982 0.62 FC(F)(F)Oc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)C3CCCCC3)c12
MCULE-9113265795 0.62 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(OCC(OCC)=O)C=2)C1=O
MolPort-007-923-092 0.62 CC1CN(CCN1c1cccc(C)c1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(cc2)C(C)(C)C)c1
MolPort-009-759-228 0.62 COc1ccc(cc1)C(=O)Nc1ccc(nc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-5956161774 0.62 C12C[C@@H](O)C(OC=1C=CC1=C2OC(C=C1)=O)(C)C
MolPort-007-923-125 0.62 Fc1cccc(F)c1C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCC(Cc2ccccc2)CC1
MolPort-007-920-953 0.62 FC(F)(F)c1cccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3cccnc3)c2)c1
MCULE-7054391047 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3=CC=CC(=C3)OC(F)F)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-001-744-060 0.62 O=C(NC1CCCCC1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cncnc1
MolPort-007-923-038 0.62 Cc1ccc(Cl)cc1NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(cc2)C(C)(C)C)c1
MCULE-7258614665 0.62 C1(C2=CC=CC=C2)=C(C)OC2C(=CC=C(OCC(C)=C)C=2)C1=O
MolPort-003-023-760 0.62 CC(C)(C)C(=O)Nc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-007-923-065 0.62 Clc1ccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3ccccc3Br)c2)cc1
MCULE-4855926487 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)OCC(C)C)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-001-744-448 0.62 CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)COc3ccccc3)c(=O)n1C2
MolPort-007-921-003 0.62 CC(=O)N1CCN(CC1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(F)cc2)c1
MCULE-9640534341 0.62 C12C(OC)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)OC(C)C)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-002-514-370 0.62 Fc1c(F)c(F)c(Oc2ccc(NC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc2)c(F)c1F
MolPort-007-922-990 0.62 Fc1ccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3c(F)cccc3F)c2)cc1F
MCULE-5010465246 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3OC)OC)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-019-555-969 0.62 CC(SC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccccc1Cl
MolPort-007-922-985 0.62 Fc1ccccc1NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccccc2Br)c1
MCULE-4956325668 0.62 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OCC3=CC=C(C=C3)Cl)C=2)CC)C1=O
MolPort-019-556-015 0.62 CC(SC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccccc1Br
MolPort-007-920-825 0.62 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)NCc1cccc(Cl)c1
MCULE-2956830380 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(Cl)C=3)O)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-029-886-050 0.62 COc1ccc(CN2C(=O)N[C@@H](CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)cc1
MolPort-001-742-871 0.62 CC(C)(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)c3ccc(F)cc3)c(=O)n1C2
MCULE-5738036556 0.62 C12C(O)=CC3=C(C(C4=CC=C(C=C4)C(OC)=O)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-029-885-559 0.62 Clc1ccccc1CN1C(=O)N[C@@H](CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MolPort-039-193-958 0.62 CCOc1ccc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C2=O)c2ccc(OC)cc2)cc1
MCULE-2089260732 0.62 C1(C=C2OC=C(C(C2=C(C=1OC)O)=O)C1C=CC(O)=CC=1)O
MolPort-027-718-031 0.62 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCN(CC1)c1ccccc1
MolPort-001-743-466 0.62 CSc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)NC(C)C)Cn2c1=O
MCULE-1747476218 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3C=C(OC)C(=C(OC)C=3)OC(C)=O)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-019-560-979 0.62 CC(SC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(cc1)C(N)=O
MolPort-001-742-854 0.62 Fc1ccc(cc1)C(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O
MCULE-7756548194 0.62 C1(C2=CC=C(C(OC)=C2)OC)=C(C)OC2C(=CC=C(OCC(=O)C3C=CC(=CC=3)OC)C=2)C1=O
MolPort-042-567-621 0.62 O=C(NCCc1cccc(=O)[nH]1)C1CC11CC1
MolPort-001-743-289 0.62 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccc(c3)C(F)(F)F)c(=O)n1C2
MCULE-3041155645 0.62 C12C(OC)=CC3=C(C(CC(=O)O3)C3C=C(OC)C(=C(OC)C=3)OC)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-027-876-824 0.62 CCN1CC(CC2(CCN(CCc3ccccn3)CC2)C1)c1ccccc1
MolPort-044-540-428 0.62 Cc1ccn(CC(=O)N2CCCC(C2)(C#N)c2ccccn2)c(=O)c1
MCULE-6723540368 0.62 C1(C2=CC=CC=C2OC)=COC2C(=CC=C(OCC(OCCCC)=O)C=2)C1=O
MolPort-044-562-601 0.62 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@H](Cn5c4cccc5=O)C3[C@@H](Cc2c1)C(=O)NCc1cccnc1
MolPort-001-744-070 0.62 O=C(N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)C1CCCCC1)c1cccs1
MCULE-9976458183 0.62 C12C(OC)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)OC)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-044-544-665 0.62 COc1ccc(CCNC(=O)[C@@H]2Cc3cc(ccc3N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@@H]23)[N+]([O-])=O)cc1OC
MolPort-038-398-758 0.62 O[C@H]1C[C@@H](C1)C(Cc1ccccn1)NC(=O)CCn1ccc(=O)[nH]c1=O
MCULE-9200553902 0.62 C1(C2=CC=CC=C2OC)=COC2C(=CC=C(OCC(OC(C)C)=O)C=2)C1=O
MolPort-044-563-935 0.62 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCC1=CCCCC1
MolPort-038-407-123 0.62 O[C@H]1C[C@H](C1)C(Cc1ccccn1)NC(=O)CCn1ccc(=O)[nH]c1=O
MCULE-4391960721 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3=COC4=C(C=C(C=C4)OC)C3=O)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-044-810-715 0.62 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCc1cccnc1
MolPort-001-743-283 0.62 OC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccc(c3)C(F)(F)F)c(=O)n1C2
MCULE-3825827811 0.62 C12OC=C(C(=O)C1=CC=C(O)C=2C(C1C=CC=CC=1)CC(OC)=O)C1=CC=C(C=C1)O
MolPort-044-563-950 0.62 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCCN1CCOCC1
MolPort-001-743-460 0.62 CSc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)CCC(O)=O)Cn2c1=O
MCULE-2595216971 0.62 C1(=C(OC)C2C=CC(=O)OC=2C=C1OC)CC(O)C(C)(C)O
MolPort-046-751-933 0.62 Cc1cccc(CCN2CC3CNCC3(CCc3ccccc3)C2)n1
MolPort-027-718-771 0.62 O=C(CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2OCC(=O)Nc2c1
MCULE-1849341199 0.62 C1(=O)C(C2C=CC(=CC=2)Cl)=COC2C=C(OC)C=C(OC)C1=2
MolPort-007-920-845 0.62 [O-][N+](=O)c1ccc(cc1)N1CCN(CC1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O
MolPort-001-744-164 0.62 CC(=O)Nc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)c3ccccc3)c12
MCULE-3011182432 0.62 C12OC=C(C(=O)C1=CC=C(OC)C=2C(CC(OC)=O)C1C=CC=C(OC)C=1)C1=CC=C(C=C1)OC
MolPort-003-057-711 0.62 COc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccccc1OC
MolPort-005-946-290 0.62 CC(=O)Nc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccncc3)Cn2c1=O
MCULE-8791349688 0.62 C12OC=C(C(=O)C1=CC=C(O)C=2C(CC(OC)=O)C1C=C(OC)C2=C(OCCO2)C=1)C1=CC=C(C=C1)O
MolPort-001-744-807 0.62 CSCC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)NC3CCCCC3)Cn2c1=O
MolPort-029-999-982 0.62 OC1=NC(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(=O)N1CCc1ccccc1
MCULE-7177953857 0.62 C12=C(O)C=C(C=C1OC1=C(C=CC=C1)C2=O)OC(C)C(C1=CC=CC=C1)=O
MolPort-005-977-881 0.62 CCOC(=O)C(=O)Nc1ccccc1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-019-607-391 0.62 CC(SC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1cccc(Cl)c1
MCULE-8626686689 0.62 C1(C[C@@H](O)C(O)(C)C)C(OC)=C2C=CC(=O)OC2=CC=1OC
MolPort-000-769-166 0.62 COc1c(Br)cc(Br)cc1CC1(CN2C[C@H]3CC(C2)c2cccc(=O)n2C3)C(=O)N(C)C(=S)N(C)C1=O
MolPort-019-616-891 0.62 [O-][N+](=O)c1ccc(NC(=O)CSC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MCULE-2551315744 0.62 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(OCC(=O)N[C@H](CO)C3C=CC=CC=3)C=2)C1=O
MolPort-001-743-942 0.62 OC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccccc1F
MolPort-001-743-868 0.62 Clc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)NC3CCCCC3)c12
MCULE-3769427879 0.62 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(OCC(=O)N[C@H](CO)CC3C=CC=CC=3)C=2)C1=O
MolPort-046-768-582 0.62 Fc1cc(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2OCOCc2c1
MolPort-005-909-568 0.62 CCOc1ccc(CC2(CN3C[C@H]4CC(C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C2=O)c2ccc(OC)cc2)cc1
MCULE-1115122847 0.62 C1=CC2OC=C(C3C=CC(OCC)=CC=3)C(=O)C=2C=C1C
MolPort-001-743-308 0.62 CSCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(Cl)cc3)c(=O)n1C2
MolPort-001-744-427 0.62 Fc1ccc(cc1)C(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccc(F)cc3)Cn2c1=O
MCULE-9994439384 0.62 COC1=CC=C(C2C(=O)C3=C(C=C(C=C3)OCC(C3=CC4=C(C=CC=C4)C=C3)=O)OC=2C(F)(F)F)C=C1
MolPort-001-743-249 0.62 Fc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc4ccccc4c3)c(=O)n1C2
MolPort-009-745-122 0.62 O=C(N1CC2CC(C1)c1cccc(=O)n1C2)c1cnn(n1)-c1ccccc1
MCULE-7465409836 0.62 C12C(OC)=CC3=C(C(CC(=O)O3)C3C=C(OC)C4=C(OCCO4)C=3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-046-424-161 0.62 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)CCCc3nc4ccccc4c(=O)[nH]3)Cn2c1=O
MolPort-000-783-254 0.62 CCOc1ccc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C2=O)c2ccc(CC)cc2)cc1
MCULE-4534393277 0.62 C12OC=C(C(=O)C1=CC=C(O)C=2C(CC(OC)=O)C1C=CC=C(OC)C=1)C1=CC=C(C=C1)O
MolPort-042-646-414 0.62 Cc1cc(=O)oc2c(C)c(O)c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc12
MolPort-002-518-653 0.62 CCCCOc1ccc(NC(=O)[C@@H](NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(C)C)cc1
MCULE-9713049114 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)OCC(O)=O)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-000-766-341 0.62 CC1(C)C(C=C(Cl)Cl)C1C(=O)NC(NC(=S)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-002-518-836 0.62 CSCC[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(C)cc1
MCULE-5324032099 0.62 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OC(=O)C3=CC=CC=C3C)C=2)CCC)C1=O
MolPort-001-744-878 0.62 CC(C)NC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(Cc4ccc(F)cc4)C3)Cn2c1=O
MolPort-000-799-160 0.62 CCOc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2ccc(OC)cc2)C1=O
MCULE-1744483446 0.62 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OC(=O)C3=CC=CC(OC)=C3)C=2)CCC)C1=O
MolPort-044-180-474 0.62 CC(C)n1ccc2cc(ccc12)C(=O)N1C[C@@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-001-744-611 0.62 OC(=O)CCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)Nc3ccccc3)c(=O)n1C2
MCULE-1996740143 0.62 C12CC(O)C(OC=1C=CC1=C2OC(C=C1)=O)(C)C
MolPort-001-744-767 0.62 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccccc3CN3CCOCC3)c(=O)n1C2
MolPort-001-744-937 0.62 Fc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)c3ccccc3)c(=O)n1C2
MCULE-1596430590 0.62 C12C=C(OCC(=O)OC)C(CCC)=CC=1C(=O)C(C1C=C3OCOC3=CC=1)=C(C)O2
MolPort-000-791-784 0.62 COc1ccc(CC2(CN3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(Cc3ccccc3)C2=O)cc1OC
MolPort-001-745-156 0.62 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(NS(=O)(=O)c3ccccc3)ccc(=O)n1C2
MCULE-1905739317 0.62 C12C(OC)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3OC)OC)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-039-346-786 0.62 Cn1nnc(n1)-c1ccc(OCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-007-931-648 0.62 CCCCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=S)Nc2cc(C)cc(C)c2)c1
MCULE-8118993969 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=CC=3F)F)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-039-194-136 0.62 O=C(\C=C\c1ccc2OCOc2c1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-001-743-948 0.62 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccccc1F
MCULE-8642272198 0.62 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(C=2)OC(C)C(OC)=O)C1=O
MolPort-005-910-562 0.62 CCOC(=O)C(=O)Nc1ccccc1C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-027-718-787 0.62 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCSCC1
MCULE-6234896083 0.62 C1(C2=CC=CC=C2OC)=COC2C(=C(O)C=C(O)C=2)C1=O
MolPort-044-180-391 0.62 Cn1ccc2cc(ccc12)C(=O)N1C[C@@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-044-544-619 0.62 Oc1c(cnc2cc(Cl)ccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-5934432529 0.62 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC=C(O)C=2C)C1=O
MolPort-001-744-931 0.62 O=C(N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccnc3)c(=O)n1C2)c1cncnc1
MolPort-044-431-950 0.62 O=C(Cn1ccc2c(cnc3ccnn23)c1=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-1031812287 0.62 C1(C2C=CC3=C(OCCO3)C=2)=COC2=C(C=CC(=C2)OC(C)C(OC)=O)C1=O
MolPort-002-514-699 0.62 COc1ccc(CC2(CN3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(CC=C)C2=O)c(OC)c1
MolPort-039-057-564 0.62 O=C(Cn1nnc2ccccc2c1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-1956118951 0.62 C1(=O)OC2=CC(=CC=C2C=C1C1=CC=C(C=C1)OC)OCC(C)=C
MolPort-044-431-316 0.62 Cn1ccc2cc(ccc12)C(=O)N1C[C@@H]2CC(C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-046-596-908 0.62 COc1ccc2[nH]c(C(=O)N3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)c(C)c2c1
MCULE-6704835597 0.62 C1(C2C=CC3=C(OCCCCO3)C=2)=C(C)OC2=C(C=C(C(OC)=C2)CC)C1=O
MolPort-044-431-328 0.62 CC(C)n1ccc2cc(ccc12)C(=O)N1C[C@@H]2CC(C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-039-193-979 0.62 COc1c(Br)cc(Br)cc1CC1(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)C(=O)N(C)C(=S)N(C)C1=O
MCULE-4358947433 0.62 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC=C(O)C=3)C=21)=O)C1C=CC=CC=1
MolPort-002-516-919 0.62 Cn1c2ncn(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c(=O)n(C)c1=O
MolPort-044-543-477 0.62 Cc1nc(C)c(o1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-5600224592 0.62 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=C(O)C=3)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-046-596-995 0.62 COc1ccc(cc1)S(=O)(=O)N1CCC(CC1)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-540-428 0.62 Cc1ccn(CC(=O)N2CCCC(C2)(C#N)c2ccccn2)c(=O)c1
MCULE-5746931238 0.62 C12C(O)=CC3=C(C(C4=CC=C(C=C4)OCC(OC)=O)CC(=O)O3)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-044-432-054 0.62 Cn1nc(C(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c2ccccc2c1=O
MolPort-044-810-878 0.62 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCc1ccccn1
MCULE-4304251084 0.62 C12C(O)=CC3=C(C(C4=CC=C(C=C4)OCCCCCCCC)CC(=O)O3)C=1OC=C(C1=CC=C(C=C1)Cl)C2=O
MolPort-044-466-160 0.62 FC(F)Oc1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1F
MolPort-038-407-123 0.62 O[C@H]1C[C@H](C1)C(Cc1ccccn1)NC(=O)CCn1ccc(=O)[nH]c1=O
MCULE-7152477040 0.62 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=C(OC)C4=C(OCCO4)C=3)C=21)=O)C1C=CC=CC=1
MolPort-035-873-947 0.62 Cn1nc(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2c1=O
MolPort-038-398-758 0.62 O[C@H]1C[C@@H](C1)C(Cc1ccccn1)NC(=O)CCn1ccc(=O)[nH]c1=O
MCULE-4050359318 0.62 C1(=O)OC2=CC(=CC=C2C=C1C1C=CC(=CC=1)OC)OCC(C)=O
MolPort-028-854-762 0.62 Cc1nc2ccc(F)cc2c(=O)n1CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-027-718-771 0.62 O=C(CN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1ccc2OCC(=O)Nc2c1
MCULE-3837766565 0.62 C1(C2=CC=C(C=C2)Br)=COC2C(=CC=C(OCC#N)C=2)C1=O
MolPort-027-564-272 0.62 COC(=O)c1ccccc1NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-029-999-982 0.62 OC1=NC(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(=O)N1CCc1ccccc1
MCULE-1532294859 0.62 C1(C2C=CC(=CC=2)OC)=COC2C(=CC=C(OCC3=CC=CC=C3C)C=2)C1=O
MolPort-044-564-847 0.62 Cn1ccc2cc(ccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-039-193-958 0.62 CCOc1ccc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C2=O)c2ccc(OC)cc2)cc1
MCULE-8223251272 0.62 C1(=O)C2C=CC(=C(C)C=2OC(C)=C1C1=CC=C(C=C1)OC)OC(C)=O
MolPort-001-743-808 0.62 COc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)CN(C)C)c12
MolPort-044-543-843 0.62 COc1ccc(CNC(=O)[C@@H]2Cc3cc(ccc3N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@@H]23)[N+]([O-])=O)cc1
MCULE-8310831331 0.62 C1(C2C=CC=CC=2)=COC2C(=CC=C(C=2)OC(C2CCCCC2)=O)C1=O
MolPort-001-744-829 0.62 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(C3)C3CCOCC3)Cn2c1=O)c1ccccc1
MolPort-046-595-440 0.62 O=C(NCC1COc2ccccc2O1)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-6148439363 0.62 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=C(O)C=3)OC)C=21)=O)C1C=CC=CC=1
MolPort-001-742-852 0.62 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O)c1ccc(cc1)C#N
MolPort-044-430-883 0.62 O=C(NCC1COc2ccccc2O1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-8278157006 0.62 C1(=COC2=C(C=CC=C2)C1=O)C1CC(=O)OC2=CC=C3C(C(C4C=CC=CC=4)=COC3=C12)=O
MolPort-001-746-588 0.62 O=c1cccc2[C@@H]3C[C@@H](CN(C[C@H]4C[N@@]5CC[C@H]4C[C@@H]5CNS(=O)(=O)c4cccs4)C3)Cn12
MolPort-044-431-285 0.62 Cc1ccc(C(O)=O)c(NC(=O)N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)c1
MCULE-3022390938 0.62 C1(C2=CC=C(C(OC)=C2)OC)=COC2C(=CC=C(OCC)C=2)C1=O
MolPort-001-745-142 0.62 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(NC(=O)c3ccc(F)cc3)ccc(=O)n1C2
MolPort-035-874-123 0.62 O=C(Cn1ccc2c(cnc3ccnn23)c1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-5837783063 0.62 C1(C2C=CC=CC=2)=C(C)OC2C(=CC=C(C=2)OC(=O)C(C)(C)C)C1=O
MolPort-030-042-364 0.62 COC(=O)c1ccccc1NC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-035-873-762 0.62 CC(C)Cn1nc(CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2c1=O
MCULE-7849258046 0.62 C1(C2=CC=C(C=C2)Cl)=COC2C(=CC=C(OCC(=O)OC(C)(C)C)C=2)C1=O
MolPort-002-516-316 0.62 CC1(C)C(C=C(Cl)Cl)C1C(=O)NC(NC(=S)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-046-482-369 0.62 Cc1nnsc1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-3123069057 0.62 C1(C2C=CC(=CC=2)Br)=COC2C(=CC=C(OC(C)=O)C=2)C1=O
MolPort-001-744-042 0.61 Fc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cccnc1
MolPort-001-742-882 0.61 CC(C)(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)Nc3cccc(F)c3)c(=O)n1C2
MCULE-6416312556 0.61 C1(C2C=CC(=CC=2)F)=COC2=C(C=C(C(O)=C2)CC)C1=O
MolPort-044-180-725 0.61 [O-][N+](=O)c1ccc2C3C[C@@H](CN(C3)C(=O)c3cc(=O)[nH]c4ccccc34)Cn2c1=O
MolPort-007-923-062 0.61 Cc1ccc(Cl)cc1NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccccc2Cl)c1
MCULE-1047515682 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3=COC4=C(C=C(C=C4)Cl)C3=O)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-039-193-967 0.61 O=c1cccc2[C@H]3C[C@@H](CN(C3)C(c3nnnn3-c3ccccc3)c3ccccc3)Cn12
MolPort-001-744-179 0.61 CC(=O)Nc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)NC3CCCCC3)c12
MCULE-1637224403 0.61 C1(C2=CC=C(C=C2)Cl)=COC2C(=CC=C(OCC(OC)=O)C=2)C1=O
MolPort-027-718-893 0.61 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(Br)c(=O)n(C)c1=O
MolPort-002-511-965 0.61 CC1=C2[C@H]3OC(=O)C(CN4C[C@H]5C[C@@H](C4)c4cccc(=O)n4C5)[C@@H]3CC[C@@]2(C)C=CC1=O
MCULE-4967305131 0.61 C1(=COC2=C(C=C(C(OC)=C2)CC)C1=O)C1=CC2=C(C=CC=C2)O1
MolPort-001-744-127 0.61 CSCC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cccc(c1)C#N
MolPort-027-848-780 0.61 Brc1ccc2c([nH]nc2c1)N1CC(CC1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-8252564154 0.61 C1(C2C=CC3=C(OCCO3)C=2)=COC2=C(C=CC(=C2)OC([C@@]([H])(C)[NH3+])=O)C1=O
MolPort-044-543-691 0.61 COc1ccc(cc1)C(=O)N1C[C@H]2C[C@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-002-524-303 0.61 COc1ccc2[nH]c3c(ncnc3c2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-8753549336 0.61 C1(C2=CC=C(C=C2)Br)=C(C)OC2C(=CC=C(OCCOC3C=CC4=C(OC(=C(C5=CC=C(C=C5)Br)C4=O)C)C=3)C=2)C1=O
MolPort-001-743-559 0.61 Cc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1ccc(\C=C\c3ccc(Cl)cc3)c(=O)n1C2
MolPort-027-718-796 0.61 CCNC(=O)c1ccc(N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(NC(=O)C(=O)OCC)c1
MCULE-7330276366 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=CC=3Cl)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-035-702-065 0.61 CSCCC(Nc1nc(C)cc(C)n1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-596-720 0.61 COc1ccc2[nH]c3c(ncnc3c2c1)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-7509875471 0.61 C1(C2=CC=C(C=C2)Cl)=COC2C(=CC=C(OCC(OCC)=O)C=2)C1=O
MolPort-002-516-229 0.61 Clc1ccccc1C(=O)NC(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-007-932-955 0.61 O=C(NCCC1=CCCCC1)c1ccc(NC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MCULE-6097738949 0.61 C1(C2C=CC=CN=2)=COC2=C(C=C(C(OCC(O)=O)=C2)CCC)C1=O
MolPort-001-743-735 0.61 CN(C)Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(Cc4cn(C)c5ccccc45)C3)Cn2c1=O
MolPort-007-931-644 0.61 Cc1ccc(CNC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=S)Nc3cc(C)cc(C)c3)c2)cc1
MCULE-7368358217 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3=CC=C4C(C=CC=N4)=C3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-039-056-833 0.61 COc1ccc(cc1)C1C(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2C(=O)N1C
MolPort-042-630-712 0.61 O=C(NCCc1cccc(=O)[nH]1)C1(CCCCC1)N1CCCCC1
MCULE-8466256861 0.61 C12OC=C(C(=O)C1=CC=C(OC)C=2C(CC(OC)=O)C1C=CC(=C(OC)C=1OC)OC)C1=CC=C(C=C1)OC
MolPort-044-478-853 0.61 FC(F)(F)c1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)nn1
MolPort-044-431-361 0.61 COc1ccc(cc1)C(NC(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O)C(C)C
MCULE-2869552742 0.61 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OCC3=CC=CC(Cl)=C3)C=2)CC)C1=O
MolPort-001-743-748 0.61 Cn1cc(CN2C[C@@H]3C[C@H](C2)c2ccc(-c4cncnc4)c(=O)n2C3)c2ccccc12
MolPort-046-066-144 0.61 COc1ccc(cc1)C(NC(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O)C(C)C
MCULE-1172492011 0.61 C1(C2=CC=C3C(OCCO3)=C2)=C(C)OC2C(=CC(=C(OCC3C=CC(=CC=3)OC)C=2)CC)C1=O
MolPort-001-743-800 0.61 COc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)c3ccccc3)c12
MolPort-027-718-530 0.61 Brc1ccc2c(n[nH]c2c1)N1CC(CC1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-3755301583 0.61 C12OC=C(C(=O)C1=CC=C(OC)C=2C(CC(OC)=O)C1=CC(OC)=C(C(OC)=C1)OC)C1=CC=C(C=C1)OC
MolPort-001-743-515 0.61 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccccc3CN(C)C)c(=O)n1C2
MolPort-007-932-438 0.61 Cc1ccc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCC=C)cc1
MCULE-7796572690 0.61 C12OC=C(C(=O)C1=CC=C(O)C=2C(C1C=CC(=CC=1)OCC(N)=O)CC(O)=O)C1=CC=C(C=C1)O
MolPort-001-744-007 0.61 CSc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)c3ccccc3)c12
MolPort-007-923-064 0.61 FC(F)(F)c1cccc(c1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(Cl)cc1
MCULE-7742641680 0.61 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(OCCN3CCN(CC3)C)C=2C)C1=O
MolPort-001-743-385 0.61 Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)COc3ccccc3)Cn2c1=O
MolPort-007-922-858 0.61 Brc1ccccc1C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N(CC=C)c1ccccc1
MCULE-3100141863 0.61 C12C(OC)=CC3=C(C(CC(=O)O3)C3=COC4=C(C=C(C=C4)OC)C3=O)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-001-743-812 0.61 COc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)CSC)c12
MolPort-001-743-983 0.61 FC(F)(F)Oc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)C3CC3)c12
MCULE-6517468506 0.61 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(OCC#N)C=2)C1=O
MolPort-000-842-812 0.61 O=C(CCCc1cn(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)c2ccccc12)N1CCOCC1
MolPort-001-743-852 0.61 Clc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)c3ccccc3)c12
MCULE-4052719280 0.61 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(C=2)OC(C)C(OCCC)=O)C1=O
MolPort-001-744-606 0.61 CC(=O)c1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2ccc(NC(=O)Nc4ccccc4)c(=O)n2C3)cc1
MolPort-001-744-178 0.61 CC(=O)Nc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)CCC(O)=O)c12
MolPort-046-423-619 0.61 COc1ccc(cc1)C(=O)N1C[C@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-039-194-087 0.61 O=C(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccc2OCOc2c1
MolPort-002-533-665 0.61 COc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1OC
MolPort-044-544-567 0.61 COc1c[nH]c(cc1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-019-639-274 0.61 CC(SC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1cc(Cl)ccc1Cl
MolPort-044-179-496 0.61 CC(C)n1ccc2ccc(cc12)C(=O)N1C[C@@H]2CC(C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-001-744-628 0.61 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)c3cnccn3)c(=O)n1C2
MolPort-044-544-023 0.61 COc1ccc2n(CCC(=O)N3CC4C[C@@H](C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc2c1
MolPort-003-023-775 0.61 O=C(Cc1ccccc1)Nc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-009-758-071 0.61 CC(O)=O.COc1ccc(\C=N\NC(=O)CC#N)cc1CN1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MolPort-001-744-110 0.61 CSCC(=O)N1C[C@@H]2C[C@H](C1)c1c(\C=C\c3ccc(Cl)cc3)ccc(=O)n1C2
MolPort-001-743-284 0.61 CC(C)(CC(O)=O)CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccc(c3)C(F)(F)F)c(=O)n1C2
MolPort-019-558-473 0.61 CC(SC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1cccc(Cl)c1Cl
MolPort-044-180-568 0.61 Cn1ccc2ccc(cc12)C(=O)N1C[C@@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-001-744-975 0.61 CN(C)CC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccc(F)cc3)Cn2c1=O
MolPort-001-743-456 0.61 CSc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccncc3)Cn2c1=O
MolPort-039-194-177 0.61 CC(C)C(=O)Nc1ccc2c(c[nH]c2c1)C(N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)C(O)=O
MolPort-044-478-880 0.61 CC(C)Cn1ncc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1C(C)C
MolPort-001-745-094 0.61 CCCS(=O)(=O)Nc1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)NC3CCCCC3)c12
MolPort-005-946-284 0.61 CN(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(OC(F)(F)F)cc3)c(=O)n1C2
MolPort-002-518-133 0.61 CSCC[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1cccc(F)c1
MolPort-009-745-161 0.61 O=C(Cn1c2ccccc2oc1=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-518-849 0.61 CCOC(=O)c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-044-431-399 0.61 O=C(Nc1ccc2OCCCOc2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-743-510 0.61 CN(C)Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)CCC(O)=O)Cn2c1=O
MolPort-044-431-317 0.61 Cn1ccc2ccc(cc12)C(=O)N1C[C@@H]2CC(C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-039-194-039 0.61 COc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(O)c(OC)c2)C1=O
MolPort-001-744-471 0.61 CC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)Nc3cccc(c3)C#N)c(=O)n1C2
MolPort-002-528-050 0.61 NS(=O)(=O)c1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-044-565-438 0.61 Cn1ccc2ccc(cc12)C(=O)N1C[C@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-007-922-600 0.61 COc1ccc(CNc2ccc(cc2[N+]([O-])=O)C(=O)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MolPort-000-853-781 0.61 O=C(COc1ccc2ccc(=O)oc2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-595-487 0.61 [O-][N+](=O)c1ccc2C3CC(CN(C3)C(=O)CCc3c[nH]c4ccccc34)Cn2c1=O
MolPort-002-514-116 0.61 Fc1ccc2[nH]c3CCN(Cc3c2c1)C(=O)CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-423-854 0.61 CC(C)C(=O)Nc1ccc2c(c[nH]c2c1)C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O
MolPort-044-564-795 0.61 CC(C)n1ccc2ccc(cc12)C(=O)N1C[C@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-001-743-128 0.61 COc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)c3ccccc3)c(=O)n1C2
MolPort-001-744-402 0.61 O=C(Nc1ccccc1)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccc4ccccc4c3)Cn2c1=O
MolPort-001-744-977 0.61 CN(C)CC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3cccnc3)Cn2c1=O
MolPort-001-744-266 0.61 CSc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(Cc4cccc(c4)C#N)C3)c12
MolPort-019-555-971 0.61 CC(SC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(C)c(Cl)c1
MolPort-000-776-482 0.61 CCCCc1c(O)nc(SCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)nc1O
MolPort-019-553-631 0.61 O=C(CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)N1CCc2ccccc12
MolPort-000-759-513 0.61 CC(C)CCc1c(O)nc(SCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)nc1O
MolPort-019-553-632 0.61 CC(SC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1c(F)c(F)cc(F)c1F
MolPort-001-744-400 0.61 CC(C)NC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccc4ccccc4c3)Cn2c1=O
MolPort-001-743-098 0.61 O=C(Nc1ccc2[C@H]3CNC[C@H](C3)Cn2c1=O)c1cnccn1
MolPort-007-931-538 0.61 O=C(CNC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)NCc1cccs1
MolPort-019-553-629 0.61 Fc1cc(Cl)ccc1NC(=O)CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-000-721-149 0.61 CC([O-])=O.COc1ccc(\C=N\NC(=O)CC#N)cc1C[NH+]1C[C@@H]2CC(C1)c1cccc(=O)n1C2
MolPort-009-138-763 0.61 O=c1[nH]c2ccccc2n1C1CCN(CCc2ccccn2)CC1
MolPort-001-743-831 0.61 Fc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc2ccccc2c1
MolPort-001-744-080 0.61 O=c1ccc(C2CCCCC2)c2[C@@H]3C[C@@H](CN(C3)S(=O)(=O)c3ccccc3)Cn12
MolPort-046-424-018 0.61 COc1cccc2c1[nH]cc(C(=O)N1C[C@H]3C[C@@H](C1)c1cccc(=O)n1C3)c2=O
MolPort-001-745-052 0.61 Fc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1c(NC(=O)C3CCCCC3)ccc(=O)n1C2
MolPort-001-744-059 0.61 CSCC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cncnc1
MolPort-046-423-751 0.61 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)CCc3c[nH]c4ccccc34)Cn2c1=O
MolPort-046-768-581 0.61 Clc1cc(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2OCOCc2c1
MolPort-046-595-486 0.61 COc1ccc(cc1)C(=O)N1CC2CC(C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-046-598-058 0.61 O=C(NC(=S)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2)c1ccc2OCOc2c1
MolPort-046-423-520 0.61 COc1ccc2n(CCC(=O)N3C[C@H]4C[C@@H](C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc2c1
MolPort-046-597-796 0.61 COc1ccc2n(CCC(=O)N3C[C@@H]4C[C@@H](C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc2c1
MolPort-044-431-381 0.61 [O-][N+](=O)c1ccc2[C@H]3C[C@@H](CN(C3)C(=O)CCc3c[nH]c4ccccc34)Cn2c1=O
MolPort-001-745-157 0.61 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(NS(=O)(=O)c3ccc(C)cc3)ccc(=O)n1C2
MolPort-001-744-327 0.61 COc1ccc(CN2C[C@@H]3C[C@H](C2)c2c(ccc(=O)n2C3)-c2ccc(NC(C)=O)cc2)cc1
MolPort-001-744-371 0.61 O=c1ccc(-c2ccccc2)c2[C@@H]3C[C@@H](CN(Cc4cccs4)C3)Cn12
MolPort-001-743-861 0.61 Clc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)c3ccncc3)c12
MolPort-002-534-623 0.61 O=C(COc1ccc2c(c1)oc(=O)c1ccccc21)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-005-133-162 0.61 Cc1oc(nc1CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)-c1ccc2ccccc2c1
MolPort-044-565-907 0.61 Oc1nc2ccccc2c(=O)n1CC(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-045-985-475 0.61 Cc1cc2c(nccn2n1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-046-564-548 0.61 O=C(N1CCOCC1)c1ccc(nc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-007-921-250 0.61 COc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccccc1F
MolPort-007-921-147 0.61 CC1CN(CCN1c1cccc(C)c1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(F)cc2)c1
MolPort-007-931-643 0.61 Cc1cc(C)cc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCC=C)c1
MolPort-007-923-066 0.61 Fc1cccc(F)c1C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(Cl)cc1
MolPort-007-922-854 0.61 COCCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccccc2Br)c1
MolPort-042-598-337 0.61 COCCCN1CCCC(C1)c1ccccn1
MolPort-044-544-072 0.61 C[C@H](NC(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O)c1nc2ccccc2[nH]1
MolPort-044-563-946 0.61 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCC1CCS(=O)(=O)C1
MolPort-044-563-934 0.61 COc1ccccc1CNC(=O)[C@@H]1Cc2cc(ccc2N2C[C@H]3C[C@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MolPort-044-431-357 0.61 CC(C)[C@H](NC(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O)c1nc2ccccc2[nH]1
MolPort-044-544-554 0.61 CC(C)[C@H](NC(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O)c1nc2ccccc2[nH]1
MolPort-044-810-751 0.61 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)N1CCCCC1c1nc2ccccc2[nH]1
MolPort-044-544-433 0.61 CC[C@H](C)[C@H](NC(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O)c1nc2ccccc2[nH]1
MolPort-027-564-552 0.61 Cc1ccc(N2CCN(Cc3c(O)c(=O)cc(CN4C[C@H]5C[C@@H](C4)c4cccc(=O)n4C5)n3C)CC2)c(C)c1
MolPort-001-743-159 0.61 O=C(NC1CCCCC1)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O
MolPort-012-000-252 0.61 CC1CN(C)C(C)CC1NCCc1ccccn1
MolPort-001-743-513 0.61 CN(C)Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)NC3CCCCC3)Cn2c1=O
MolPort-030-043-591 0.61 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccc2NC(=O)COc2c1
MolPort-002-519-090 0.61 CSCC[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1cccc(C)c1
MolPort-001-744-388 0.61 CSCC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccc4ccccc4c3)Cn2c1=O
MolPort-029-885-906 0.61 O=C(CC[C@@H]1NC(=O)N(Cc2ccco2)C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-744-019 0.61 CSc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)CCC(O)=O)c12
MolPort-001-745-050 0.61 Fc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1c(NC(=O)c3ccccc3)ccc(=O)n1C2
MolPort-001-744-113 0.61 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1c(\C=C\c3ccc(Cl)cc3)ccc(=O)n1C2
MolPort-005-946-258 0.61 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(C3)c3ncccn3)Cn2c1=O)c1ccncc1
MolPort-019-639-570 0.61 Cc1c(Cl)cccc1NC(=O)CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-517-960 0.61 CSCC[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(F)cc1
MolPort-007-981-021 0.61 O=C(Nc1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)C#N)c1cccs1
MolPort-007-921-116 0.61 CCOc1ccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3ccncc3)c2)cc1
MolPort-007-931-081 0.61 CCc1ccc(NC(=O)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCc2ccc(F)cc2)cc1
MolPort-035-873-877 0.61 Cc1c(oc2ccccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-743-563 0.61 COCCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(\C=C\c3ccc(Cl)cc3)c(=O)n1C2
MolPort-002-535-482 0.61 Oc1cc(OCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)ccc1-c1n[nH]cc1-c1ccccc1
MolPort-005-946-330 0.61 OC(=O)COCC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccccc1
MolPort-001-744-043 0.61 O=C(N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cccnc1)c1ccc(cc1)C#N
MolPort-001-743-490 0.61 O=C(Nc1ccccc1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccnc3)c(=O)n1C2
MolPort-001-743-680 0.61 Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(Cc4cccs4)C3)Cn2c1=O
MolPort-044-544-390 0.61 [O-][N+](=O)c1ccc2[C@@H]3C[C@H](CN(C3)C(=O)CCc3c[nH]c4ccccc34)Cn2c1=O
MolPort-035-873-449 0.61 O=C(Cc1csc(n1)-c1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-027-718-533 0.61 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCN(Cc2cccc(Cl)c2)CC1
MolPort-002-535-216 0.61 COc1ccc(cc1)-c1c[nH]nc1-c1ccc(OCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1O
MolPort-001-743-906 0.61 O=c1ccc(-c2cccs2)c2[C@H]3CNC[C@H](C3)Cn12
MCULE-7594898185 0.61 C12C(O)=CC3=C(C(C4C=CC(=CC=4)OCC(C)=C)CC(=O)O3)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-001-744-228 0.61 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cccs1
MCULE-1778551106 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3C=C(OC)C(=CC=3OC)OC)C=1OC=C(C1=CC=CC=C1)C2=O
MolPort-044-179-577 0.61 Cc1c(C)c(=O)oc2c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c(O)ccc12
MCULE-5847487167 0.61 C12C(O)=CC3=C(C(C4C=CC(=CC=4)OCCCCCCCC)CC(=O)O3)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-009-705-706 0.61 COc1ccc(cc1)-c1c[nH]nc1-c1ccc(OCCN2CC3CC(C2)c2cccc(=O)n2C3)cc1O
MCULE-1222318099 0.61 C12OC=C(C(=O)C1=CC=C(O)C=2C(CC(OC)=O)C1C=CC(=C(OC)C=1)OC(C)C)C1=CC=C(C=C1)O
MolPort-007-922-988 0.61 Fc1ccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3cccc(c3)C(F)(F)F)c2)cc1F
MCULE-6117872974 0.61 C12C=C3C[C@H](C(C)(OC(/C=C(\C)/C)=O)C)OC3=CC=1OC(=O)C=C2
MolPort-001-744-051 0.61 O=C(N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cncnc1)c1ccccc1
MCULE-9877188395 0.61 CC1OC2C(=C(O)C3CC(OC4OC(CO)C(O)C(O)C4O)C(C)(C)OC=3C=2)C(=O)C=1
MolPort-009-705-707 0.61 Oc1cc(OCCN2CC3CC(C2)c2cccc(=O)n2C3)ccc1-c1n[nH]cc1-c1ccccc1
MCULE-2931129619 0.61 C12OC=C(C(=O)C1=CC=C(O)C=2C(C1C=CC(=CC=1)C(C)C)CC(OC)=O)C1=CC=C(C=C1)O
MolPort-001-743-508 0.61 CN(C)Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccncc3)Cn2c1=O
MCULE-2650096041 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)O)C=1OC=C(C1=CC=CC=C1OC)C2=O
MolPort-044-431-378 0.61 COc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MCULE-4192742073 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3=CC=C4C(C=CC=N4)=C3)C=1OC=C(C1=CC=CC=C1)C2=O
MolPort-045-945-653 0.61 Cc1cccc(=O)n1CCCNC(=O)C1CCCc2c1[nH]c1ccccc21
MCULE-7991133040 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)OC)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-001-745-089 0.61 O=C(NC1CCCCC1)N1C[C@@H]2C[C@H](C1)c1c(NC(=O)c3ccccc3)ccc(=O)n1C2
MCULE-4815838062 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(O)C=3)OC)C=1OC=C(C1=CC=CC=C1OC)C2=O
MolPort-007-923-214 0.61 COc1ccc(CNC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3ccc(cc3)C(C)(C)C)c2)cc1
MCULE-4215688912 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)OCC(C)C)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-007-923-186 0.61 Fc1cccc(F)c1C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCN(Cc2ccccc2)CC1
MCULE-6192691362 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3=COC4=C(C=CC=C4)C3=O)C=1OC=C(C1=CC=CC=C1OC)C2=O
MolPort-007-920-848 0.61 CCOc1ccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(c2)[N+]([O-])=O)cc1
MCULE-3372564120 0.61 C1(C(=O)C2C(=CC(=CC=2)OCC(=O)NC(CO)C2C=CC=CC=2)OC=1)C1C=CC=CC=1
MolPort-007-922-581 0.61 COc1ccccc1NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O
MCULE-8639330121 0.61 C12C(O)=CC3=C(C(C4C=CN=CC=4)CC(=O)O3)C=1OC=C(C1=CC=CC=C1)C2=O
MolPort-007-931-470 0.61 CCCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)Nc2ccc(Cl)cc2)c1
MCULE-7318659651 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)OC(C)C)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-008-365-660 0.61 Cc1ccccc1-c1cnc(N)c(n1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-5604656046 0.61 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=C(OC)C(=CC=3OC)OC)C=21)=O)C1=CC=C(C=C1)O
MolPort-002-517-015 0.61 COc1ccc2n(Cc3ccccc3)c(C)c(C(=O)CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-007-921-047 0.61 COc1ccccc1NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccncc2)c1
MCULE-5029333687 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3=CC(OC)=C(C(OC)=C3)O)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-002-516-392 0.61 ClC(Cl)(Cl)C(NC(=O)c1ccccc1Br)NC(=S)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-194-015 0.61 Fc1ccc2[nH]c3CCN(Cc3c2c1)C(=O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-7339746991 0.61 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=C(OC)C=3OC)OC)C=21)=O)C1C=CC=CC=1
MolPort-001-743-282 0.61 CSCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccc(c3)C(F)(F)F)c(=O)n1C2
MolPort-007-921-120 0.61 Fc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCN(CC1)c1ccccc1
MCULE-5460402516 0.61 C1(=O)C(C2C=CC=CC=2)=COC2=CC(O)=CC(O)=C12
MolPort-046-423-556 0.61 COc1cc2[nH]c(cc2c(OC)c1OC)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-873-481 0.61 Cn1ncc(C(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c1-n1cccc1
MCULE-3597268493 0.61 C12OC(C)=CC(=O)C=1C(O)=C1C[C@H](O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)C(C)(C)OC1=C2
MolPort-001-743-384 0.61 Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccc(F)cc3)Cn2c1=O
MolPort-029-884-974 0.61 COc1ccccc1CN1C(=O)N[C@@H](CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MCULE-7724132365 0.61 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=C(OC)C=3)O)C=21)=O)C1C=CC=CC=1
MolPort-044-431-372 0.61 [O-][N+](=O)c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)CCCc3c[nH]c4ccccc34)Cn2c1=O
MolPort-042-598-337 0.61 COCCCN1CCCC(C1)c1ccccn1
MCULE-8587166601 0.61 C1=C2OC(C=CC2=CC2=C1OC(C(OC(=O)/C(/C)=C\C)(C)C)C2)=O
MolPort-035-873-296 0.61 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cc(n[nH]1)-c1ccccc1
MolPort-044-563-934 0.61 COc1ccccc1CNC(=O)[C@@H]1Cc2cc(ccc2N2C[C@H]3C[C@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MCULE-3247673835 0.61 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC4=C(OCCO4)C=3)C=21)=O)C1C=CC=CC=1
MolPort-001-743-403 0.61 Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(C3)S(C)(=O)=O)Cn2c1=O
MolPort-044-810-751 0.61 [O-][N+](=O)c1ccc2N3C[C@@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)N1CCCCC1c1nc2ccccc2[nH]1
MCULE-9814687802 0.61 C12=C(C)C3OC(C)(C)CCC=3C=C1C1=C(C=C(C=C1)OC)C(=O)O2
MolPort-044-180-885 0.61 CCc1cc(=O)oc2c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c(O)ccc12
MolPort-044-431-357 0.61 CC(C)[C@H](NC(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O)c1nc2ccccc2[nH]1
MCULE-8096549712 0.61 C1(OC)C(CCC(O)(C)C)=C2C(=O)C3C4OC(C)(C)CCC=4C(O)=CC=3OC2=CC=1O
MolPort-002-516-131 0.61 Clc1cccc(c1)C(=O)NC(NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-044-563-946 0.61 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCC1CCS(=O)(=O)C1
MCULE-6957863909 0.61 C12OC=C(C(=O)C1=CC=C(O)C=2C(CC(OC)=O)C1C=CC(=C(O)C=1)OC)C1=CC=C(C=C1)O
MolPort-001-743-225 0.61 COc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccncc3)Cn2c1=O
MolPort-044-544-072 0.61 C[C@H](NC(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O)c1nc2ccccc2[nH]1
MCULE-1027180042 0.61 C12C=C(C(O)=CC=1OC=C(C1C=CC(OC)=CC=1)C2=O)O
MolPort-001-743-220 0.61 COc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(OC)cc3)c(=O)n1C2
MolPort-044-544-554 0.61 CC(C)[C@H](NC(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O)c1nc2ccccc2[nH]1
MCULE-1200621279 0.61 C12OC=C(C(=O)C1=CC=C1OC(CC(C3=CC=C(C=C3)C(O)=O)C=21)=O)C1C=CC(=CC=1)O
MolPort-046-595-391 0.61 CCc1cc(=O)oc2c(C)c(O)c(CN3CC4CC(C3)c3cccc(=O)n3C4)cc12
MolPort-044-544-433 0.61 CC[C@H](C)[C@H](NC(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O)c1nc2ccccc2[nH]1
MCULE-3270442063 0.61 C1(C(=O)OC2C=C(C=CC=2C=1)O)C1C=CC(OCCCC)=CC=1
MolPort-001-743-245 0.61 COc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc4ccccc4c3)c(=O)n1C2
MolPort-029-885-906 0.61 O=C(CC[C@@H]1NC(=O)N(Cc2ccco2)C1=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-5225351097 0.61 C1(=O)C(C2C=CC(=C(OC)C=2)OC)=COC2C=C(C=C(OC)C1=2)OC
MolPort-039-194-168 0.61 COc1ccc2[nH]cc(C(N3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)C(O)=O)c2c1
MolPort-027-564-552 0.61 Cc1ccc(N2CCN(Cc3c(O)c(=O)cc(CN4C[C@H]5C[C@@H](C4)c4cccc(=O)n4C5)n3C)CC2)c(C)c1
MCULE-1895776647 0.61 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC=C(OC)C=3OC)C=21)=O)C1=CC=C(C=C1)O
MolPort-001-743-279 0.61 FC(F)(F)c1cccc(c1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccncc3)Cn2c1=O
MolPort-030-043-591 0.61 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccc2NC(=O)COc2c1
MCULE-8145735637 0.61 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=C(OC)C=3)OC)C=21)=O)C1=CC=C(C=C1)O
MolPort-044-632-808 0.61 Clc1ccc(CNC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)s1
MolPort-044-431-376 0.61 CC(=O)Nc1cccc2n(CC(=O)N3C[C@H]4C[C@@H](C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc12
MCULE-6702825182 0.61 C1(=COC2=C(C=C(C=C2)OC)C1=O)C1CC(=O)OC2=CC=C3C(C(C4=CC=C(C=C4)O)=COC3=C12)=O
MolPort-046-595-482 0.61 [O-][N+](=O)c1ccc2C3CC(CN(C3)C(=O)CCCc3c[nH]c4ccccc34)Cn2c1=O
MolPort-042-566-922 0.61 CN1CCC(CNC(=O)CCn2c(C)cccc2=O)(CC1)c1ccccc1
MCULE-4511611488 0.61 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=C(OC)C=3)OC(C)C)C=21)=O)C1=CC=C(C=C1)O
MolPort-001-743-580 0.61 O=C(N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccc(c3)C#N)c(=O)n1C2)c1ccc(cc1)C#N
MolPort-045-945-653 0.61 Cc1cccc(=O)n1CCCNC(=O)C1CCCc2c1[nH]c1ccccc21
MCULE-7127787182 0.61 O1C(CC2=CC3C=CC(=O)OC=3C=C12)C(C)(C)OC(C1C=CC=CC=1)=O
MolPort-001-743-567 0.61 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(\C=C\c3ccc(Cl)cc3)c(=O)n1C2
MolPort-039-193-964 0.61 Cc1ccccc1-n1nnnc1C1(CCCCC1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-8153375493 0.61 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=C(OC)C=3OC)OC)C=21)=O)C1=CC=C(C=C1)O
MolPort-005-910-971 0.61 COc1ccc2[nH]cc(C(N3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(O)=O)c2c1
MolPort-039-193-961 0.61 COc1ccc(cc1CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(C1=C(O)CC(C)(C)CC1=O)C1=C(O)CC(C)(C)CC1=O
MCULE-3254158674 0.61 C12CC(O)C(C)(C)OC=1C=C1OC(C3C=C(O)C=C(O)C=3)=CC1=C2
MolPort-046-597-637 0.61 COc1ccc(cc1)-c1[nH]ncc1C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-194-168 0.61 COc1ccc2[nH]cc(C(N3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)C(O)=O)c2c1
MCULE-2689331400 0.61 C12OC=C(C3C=CC(O)=CC=3)C(=O)C=1C(O)=CC(O[C@H]1[C@H](O)[C@H]([C@H](O)[C@@H](CO)O1)O)=C2
MolPort-044-544-615 0.61 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)CCCc3c[nH]c4ccccc34)Cn2c1=O
MolPort-046-423-556 0.61 COc1cc2[nH]c(cc2c(OC)c1OC)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-1086298542 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(O)C=3)OC)C=1OC=C(C1=CC=C(C=C1)Cl)C2=O
MolPort-046-597-418 0.61 COCCn1cc(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2cc(Cl)ccc12
MolPort-046-595-482 0.61 [O-][N+](=O)c1ccc2C3CC(CN(C3)C(=O)CCCc3c[nH]c4ccccc34)Cn2c1=O
MCULE-3202631412 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=C(OC)C=3OC)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-004-831-606 0.61 ClC(Cl)(Cl)C(NC(=O)c1ccccc1Br)NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-044-431-372 0.61 [O-][N+](=O)c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)CCCc3c[nH]c4ccccc34)Cn2c1=O
MCULE-4827069961 0.61 C1=C2OC(C=CC2=CC2=C1OC(C(OC(=O)/C=C(\C)/C)(C)C)C2)=O
MolPort-001-744-270 0.61 O=c1ccc(-c2cccnc2)c2[C@@H]3C[C@@H](CN(Cc4cccs4)C3)Cn12
MolPort-039-194-090 0.61 COc1ccc2n(Cc3ccccc3)c(C)c(C(=O)CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1
MCULE-4594371169 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3=CC(OC)=C(C(OC)=C3)OC)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-001-744-118 0.61 O=C(N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cccc(c1)C#N)c1ccccc1
MolPort-044-180-885 0.61 CCc1cc(=O)oc2c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c(O)ccc12
MCULE-5697921825 0.61 C1(C(C2C(=C(C)C(=CC=2)OCCN2CCN(CC2)CC)OC=1)=O)C1=CC=C(C=C1)OC.Cl.Cl
MolPort-005-946-310 0.61 COCCC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc(SC)cc1
MolPort-039-347-309 0.61 O=C(N1CC2CC(C1)c1cccc(=O)n1C2)c1cc([nH]n1)-c1ccccc1
MCULE-7652535382 0.61 Cl.Cl.C1(C(C2C(=C(C)C(=CC=2)OCCN2CCN(CC2)C)OC=1)=O)C1=CC=C(C=C1)OC
MolPort-039-194-090 0.61 COc1ccc2n(Cc3ccccc3)c(C)c(C(=O)CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1
MolPort-044-431-180 0.61 COc1cc(OC)c2cc(C(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)n(C)c2c1
MCULE-5359710569 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3C=C(OC)C4=C(OCCO4)C=3)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-039-056-081 0.61 COc1ccc(cc1)-c1n[nH]cc1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-042-646-415 0.61 CCc1cc(=O)oc2c(C)c(O)c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc12
MCULE-1862597464 0.61 C1(C2=CC=C(C(OC)=C2)OC)=COC2C(=CC=C(OCC(OC)=O)C=2)C1=O
MolPort-035-372-433 0.61 COc1cccc2C=C(CN3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)COc12
MolPort-044-544-615 0.61 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)CCCc3c[nH]c4ccccc34)Cn2c1=O
MCULE-6551341458 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC(C)C)C=3)OC)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-042-646-415 0.61 CCc1cc(=O)oc2c(C)c(O)c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)cc12
MolPort-045-985-475 0.61 Cc1cc2c(nccn2n1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-1212318745 0.61 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(OCCN3CCN(CC3)CC)C=2C)C1=O
MolPort-044-431-180 0.61 COc1cc(OC)c2cc(C(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)n(C)c2c1
MolPort-046-423-619 0.61 COc1ccc(cc1)C(=O)N1C[C@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MCULE-3462482152 0.61 C1C(=C2C(=O)C(C3C=CC(=CC=3)O)=COC2=CC=1O[C@@H]1O[C@H](CO)[C@@H](O)[C@H](O)[C@H]1O)O
MolPort-001-744-177 0.61 CSCC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc(NC(C)=O)cc1
MolPort-035-814-393 0.61 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cc([nH]n1)-c1ccccc1
MCULE-7791189647 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)O)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-044-431-376 0.61 CC(=O)Nc1cccc2n(CC(=O)N3C[C@H]4C[C@@H](C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc12
MolPort-044-566-238 0.61 COc1cnc(cc1O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-1327792496 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3=COC4=C(C=CC=C4)C3=O)C=1OC=C(C1=CC=C(C=C1)Cl)C2=O
MolPort-029-884-974 0.61 COc1ccccc1CN1C(=O)N[C@@H](CC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MolPort-027-718-060 0.61 Cc1cccc(N2CCN(Cc3c(O)c(=O)cc(CN4C[C@H]5C[C@@H](C4)c4cccc(=O)n4C5)n3C)CC2)c1C
MCULE-2034768084 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)O)C=1OC=C(C1=CC=C(C=C1)Cl)C2=O
MolPort-021-764-223 0.61 O=C(Cn1ccccc1=O)N1CC[C@@H]2[C@@H](CCC(=O)N2CCc2ccccn2)C1
MolPort-046-423-854 0.61 CC(C)C(=O)Nc1ccc2c(c[nH]c2c1)C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O
MCULE-4258990390 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=C(OC)C=3)C=1OC=C(C1=CC=C(C=C1)Cl)C2=O
MolPort-042-566-922 0.61 CN1CCC(CNC(=O)CCn2c(C)cccc2=O)(CC1)c1ccccc1
MolPort-039-194-039 0.61 COc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(O)c(OC)c2)C1=O
MCULE-5312135013 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC4=C(OCCO4)C=3)C=1OC=C(C1=CC=C(C=C1)Cl)C2=O
MolPort-039-193-961 0.61 COc1ccc(cc1CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(C1=C(O)CC(C)(C)CC1=O)C1=C(O)CC(C)(C)CC1=O
MolPort-039-194-177 0.61 CC(C)C(=O)Nc1ccc2c(c[nH]c2c1)C(N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)C(O)=O
MCULE-6810479473 0.61 C1(C(F)(F)F)OC2=CC(=CC=C2C(=O)C=1C1C=CC=CC=1)OCC(C1C=CC=CC=1)=O
MolPort-002-511-777 0.61 COc1ccc(cc1CN1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(C1=C(O)CC(C)(C)CC1=O)C1=C(O)CC(C)(C)CC1=O
MolPort-027-718-060 0.61 Cc1cccc(N2CCN(Cc3c(O)c(=O)cc(CN4C[C@H]5C[C@@H](C4)c4cccc(=O)n4C5)n3C)CC2)c1C
MCULE-6439900572 0.61 O1[C@@H](CC2=CC3C=CC(=O)OC=3C=C12)C(C)(C)OC(C1C=CC=CC=1)=O
MolPort-001-744-409 0.61 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccc(cc3)-c3ccccc3)Cn2c1=O)C1CCCCC1
MolPort-039-056-833 0.61 COc1ccc(cc1)C1C(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc2C(=O)N1C
MCULE-7486740358 0.61 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=C(OC)C(=C(OC)C=3)OC)C=21)=O)C1C=CC=CC=1
MolPort-000-757-730 0.61 COc1ccc(cc1CN1CC2CC(C1)c1cccc(=O)n1C2)C(C1=C(O)CC(C)(C)CC1=O)C1=C(O)CC(C)(C)CC1=O
MolPort-044-543-691 0.61 COc1ccc(cc1)C(=O)N1C[C@H]2C[C@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MCULE-8892199188 0.61 C12OC=C(C(=O)C=1C=CC1OC(CC(C3C=CC=CC=3OCC(OC)=O)C2=1)=O)C1C=CC(=CC=1)F
MolPort-039-193-964 0.61 Cc1ccccc1-n1nnnc1C1(CCCCC1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-423-751 0.61 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)CCc3c[nH]c4ccccc34)Cn2c1=O
MCULE-3233025251 0.61 C12C=C(C=C(O)C=1C(=O)C(C1=CC=C(OC)C(O)=C1)=CO2)O
MolPort-007-931-471 0.61 Clc1ccc(NC(=O)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NC2CCCCCCC2)cc1
MolPort-046-595-408 0.61 Cc1c(C)c(=O)oc2c(CN3CC4CC(C3)c3cccc(=O)n3C4)c(O)ccc12
MCULE-2620180146 0.61 C12OC=C(C(=O)C1=CC=C(O)C=2C(CC(OC)=O)C1C=CC(=C(C)C=1)C)C1=CC=C(C=C1)O
MolPort-000-802-692 0.61 ClC(Cl)(Cl)C(NC(=O)c1ccccc1Br)NC(=S)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-044-180-725 0.61 [O-][N+](=O)c1ccc2C3C[C@@H](CN(C3)C(=O)c3cc(=O)[nH]c4ccccc34)Cn2c1=O
MCULE-5239399508 0.61 C1(O)C=C2OC=C(C3C=C(C/C=C(\C)/C)C(O)=CC=3)C(=O)C2=C(O)C=1C/C=C(\C)/C
MolPort-035-873-164 0.61 COCCCn1c(C)cc(C)c(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1=O
MolPort-044-544-390 0.61 [O-][N+](=O)c1ccc2[C@@H]3C[C@H](CN(C3)C(=O)CCc3c[nH]c4ccccc34)Cn2c1=O
MCULE-1416604777 0.61 O([C@H]1[C@@H]([C@H]([C@@H]([C@@H](CO)O1)O)O)O)[C@H]1CC2=C(C3C(C=C(C)OC=3C=C2OC1(C)C)=O)O
MolPort-001-743-864 0.61 CSCC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc(Cl)cc1
MolPort-045-968-535 0.61 Clc1cccc(c1)-c1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)o1
MCULE-7985806175 0.61 C12OC=C(C(=O)C1=CC=C(O)C=2C(CC(OC)=O)C1=CC(OC)=C(C(OC)=C1)OC)C1=CC=C(C=C1)O
MolPort-001-743-832 0.61 O=C(COc1ccccc1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc2ccccc2c1
MolPort-044-431-381 0.61 [O-][N+](=O)c1ccc2[C@H]3C[C@@H](CN(C3)C(=O)CCc3c[nH]c4ccccc34)Cn2c1=O
MCULE-3055290907 0.61 C1(=O)C2C=CC(=C(C)C=2OC(C)=C1C1=CC=CC=C1)OC(C)=O
MolPort-001-743-937 0.61 Fc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccccc1F
MolPort-046-489-585 0.61 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1cn2CCCCc2n1
MCULE-1118586407 0.61 C1(C2C=CC=CN=2)=COC2=C(C=C(C(OC(C)=O)=C2)CCCC)C1=O
MolPort-035-814-393 0.61 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cc([nH]n1)-c1ccccc1
MolPort-035-873-449 0.61 O=C(Cc1csc(n1)-c1ccccc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-8494483029 0.61 C1(C2C=CC3=C(OCCO3)C=2)=COC2=C(C=CC(OC(C)=O)=C2)C1=O
MolPort-002-518-358 0.61 CCCCOc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1
MolPort-039-193-967 0.61 O=c1cccc2[C@H]3C[C@@H](CN(C3)C(c3nnnn3-c3ccccc3)c3ccccc3)Cn12
MCULE-3549482933 0.61 C1(C2=CC=C(C=C2)Cl)=COC2C(=CC=C(C=2)OC(C)C(OCC)=O)C1=O
MolPort-001-744-612 0.61 OC(=O)CCCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)Nc3ccccc3)c(=O)n1C2
MolPort-027-718-533 0.61 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCN(Cc2cccc(Cl)c2)CC1
MCULE-7072482384 0.61 C1(CC)=CC2C(=O)C(C3C=CC4OCOC=4C=3)=C(C)OC=2C=C1OCC(O)=O
MolPort-001-744-024 0.61 CSc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)NC(C)C)c12
MolPort-035-873-877 0.61 Cc1c(oc2ccccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-8150369751 0.61 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OC(=O)C3=CC=C(C(OC)=C3)OC)C=2)CCC)C1=O
MolPort-002-533-924 0.61 COc1cc2[nH]c(cc2c(OC)c1OC)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-035-702-065 0.61 CSCCC(Nc1nc(C)cc(C)n1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-9781615490 0.61 C1(=O)OC2=CC(=CC=C2C=C1C1=CC=C(C=C1)OC)OCC(O)=O
MolPort-028-738-482 0.61 CC(C)c1nc2cc(ccc2o1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-046-595-487 0.61 [O-][N+](=O)c1ccc2C3CC(CN(C3)C(=O)CCc3c[nH]c4ccccc34)Cn2c1=O
MCULE-5102735085 0.61 C1(=O)OC2=CC(=CC=C2C=C1C1C=CC=CC=1)OC(C)C(O)=O
MolPort-001-743-582 0.61 O=C(N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccc(c3)C#N)c(=O)n1C2)c1ccncc1
MolPort-044-179-577 0.61 Cc1c(C)c(=O)oc2c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c(O)ccc12
MCULE-2375201511 0.61 C1(C2C=CC=CC=2)=COC2C(=CC=C(OCC3=CC=C(C=C3)Br)C=2)C1=O
MolPort-035-873-254 0.61 COCCn1cc(C(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c2cc(Cl)ccc12
MolPort-044-431-378 0.61 COc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MCULE-5168179301 0.61 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC=C(OCC#N)C=2)C1=O
MolPort-001-744-923 0.61 O=C(N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc2ccccc2c1)c1cncnc1
MolPort-046-779-407 0.61 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccc2cn[nH]c2n1
MCULE-5697364801 0.61 C1(C2C=CC=CC=2)=C(C)OC2C(=CC=C(OCC)C=2)C1=O
MolPort-000-772-215 0.61 COc1cc(CC2(CN3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=O)N(C)C2=O)ccc1OCc1ccc(F)cc1
MolPort-046-595-486 0.61 COc1ccc(cc1)C(=O)N1CC2CC(C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MCULE-5892074151 0.61 C1(C2C=CC(=CC=2)F)=COC2C(=CC=C(OCC(OCC)=O)C=2)C1=O
MolPort-001-743-818 0.61 COc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)NC(C)C)c12
MolPort-044-478-853 0.61 FC(F)(F)c1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)nn1
MCULE-1089769604 0.61 C1(C(F)(F)F)OC2=C(C)C(OCCC)=CC=C2C(=O)C=1C1C=CC(=CC=1)OC
MolPort-001-744-929 0.61 Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3cncnc3)Cn2c1=O
MolPort-027-718-893 0.61 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(Br)c(=O)n(C)c1=O
MCULE-9167287050 0.61 C1(=O)C2=CC=C(C(C)=C2OC(C)=C1C1C=CC(=CC=1)OC)OC
MolPort-006-820-497 0.61 Cc1cc(O)nc(NC(=N)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)n1
MolPort-046-595-391 0.61 CCc1cc(=O)oc2c(C)c(O)c(CN3CC4CC(C3)c3cccc(=O)n3C4)cc12
MCULE-4209496515 0.61 C1(C2=CC=CC=C2)=C(C)OC2C(=CC=C(C=2)OC(C)C(OC)=O)C1=O
MolPort-039-347-309 0.61 O=C(N1CC2CC(C1)c1cccc(=O)n1C2)c1cc([nH]n1)-c1ccccc1
MolPort-035-873-164 0.61 COCCCn1c(C)cc(C)c(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1=O
MCULE-7831436349 0.61 C1(=O)C2=CC=C(C(C)=C2OC(C)=C1C1=CC=C(C=C1)OC)OCC1=CC=CC=C1
MolPort-001-744-181 0.61 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc(NC(C)=O)cc1
MolPort-035-874-280 0.61 O=C(Nc1ccccc1C(=O)NCc1ccccn1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-1697695124 0.61 C1(C2C=CC3=C(OCO3)C=2)=C(CC)OC2=C(C=C(C(OC(C)C)=C2)CCC)C1=O
MolPort-030-062-164 0.61 Cc1cc(C)cc(c1)C1(CNC(=O)CCn2c(C)cccc2=O)CCCC1
MolPort-044-431-399 0.61 O=C(Nc1ccc2OCCCOc2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-9120776323 0.61 C1(C2=CC=CC=C2)=COC2C(=CC=C(OCC(N)=O)C=2)C1=O
MolPort-002-929-677 0.61 O=C(CC(=O)c1ccccc1)N1CC2CC(C1)n1c(C2)cccc1=O
MolPort-046-424-018 0.61 COc1cccc2c1[nH]cc(C(=O)N1C[C@H]3C[C@@H](C1)c1cccc(=O)n1C3)c2=O
MCULE-9727843102 0.61 C1(=O)C(C2C=CC3=C(OCCCO3)C=2)=COC2C=C(OC(C)=O)C=C(OC(C)=O)C1=2
MolPort-001-744-938 0.61 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccn3)Cn2c1=O)c1ccccc1
MolPort-044-566-752 0.61 FC(F)(F)c1ccc2sc(cc2c1)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-4741334950 0.61 C1(C2=CC=CC=C2)=COC2C(=CC=C(OCC(=O)N[C@H](CO)C3C=CC=CC=3)C=2)C1=O
MolPort-019-555-929 0.61 CC(SC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1cc(Cl)cc(Cl)c1
MolPort-046-595-490 0.61 O=C(Nc1ccc2OCCCOc2c1)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-2845910629 0.61 C1(=O)C(C2=CC=C(C=C2)OC2OC(CO)C(C(O)C2O)O)=COC2C=C(OCC)C=C(O)C1=2
MolPort-019-611-178 0.61 Cc1ccc(NC(=O)CSC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1Cl
MolPort-029-885-008 0.61 COc1ccccc1CN1C(=O)N[C@@H](CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MCULE-8518235736 0.61 C1(C2=CC=CC=C2)=COC2C(=CC=C(OCC(=O)NC(C)CCC3C=CC=CC=3)C=2)C1=O
MolPort-002-742-508 0.61 Clc1ccc(cc1)N1C(=O)C=C(N2CC3CC(C2)c2cccc(=O)n2C3)C1=O
MolPort-044-478-880 0.61 CC(C)Cn1ncc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)c1C(C)C
MCULE-2734866840 0.61 C1(C2=CC=C3C(OCCO3)=C2)=C(C)OC2C(=CC(=C(OCC3C=CC(=CC=3)C)C=2)CC)C1=O
MolPort-042-629-398 0.61 Cn1cncc1-c1cccc(c1)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-431-317 0.61 Cn1ccc2ccc(cc12)C(=O)N1C[C@@H]2CC(C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MCULE-3844578008 0.61 C1(C2=CC=C3C(OCO3)=C2)=C(C)OC2=C(C=C(C(OC(C)C)=C2)CC)C1=O
MolPort-001-744-794 0.61 COCCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)CSC)c(=O)n1C2
MolPort-044-180-568 0.61 Cn1ccc2ccc(cc12)C(=O)N1C[C@@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MCULE-4829356764 0.61 C1(C2=CC=C3C(OCCCO3)=C2)=C(CCC)OC2=C(C=C(C(OC(C)C)=C2)CC)C1=O
MolPort-044-566-764 0.61 O=C(COc1ccc2CCC(=O)Nc2c1)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-564-795 0.61 CC(C)n1ccc2ccc(cc12)C(=O)N1C[C@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MCULE-6246441417 0.61 C1(C2C=CC=CC=2)=COC2C(=CC=C(OCC(=O)NC(CO)CC3C=CC=CC=3)C=2)C1=O
MolPort-019-558-360 0.61 CC(SC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(Cl)cc1Cl
MolPort-046-179-097 0.61 CNC(=O)c1ccc(cc1)S(=O)(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-4385583498 0.61 C1(C2C=CC(=CC=2)Cl)=COC2=C(C=C(C(O)=C2)CC)C1=O
MolPort-019-618-929 0.61 Fc1cc(F)c(F)c(NC(=O)CSC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)c1F
MolPort-046-768-581 0.61 Clc1cc(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2OCOCc2c1
MCULE-6992098620 0.61 C1(C2C=CC=CC=2)=COC2C(=CC=C(OCC(=O)N[C@H](CO)CC3C=CC=CC=3)C=2)C1=O
MolPort-001-744-768 0.61 CSCC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O
MolPort-044-565-438 0.61 Cn1ccc2ccc(cc12)C(=O)N1C[C@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MCULE-1753914297 0.61 C1(=O)C(C2=CC=C3C(OCCCO3)=C2)=COC2C=C(OC(=O)[C@]([H])(N)CC3C=CC=CC=3)C=C(O)C1=2
MolPort-019-634-989 0.61 CC(=O)c1cccc(NC(=O)CSC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)c1
MolPort-038-432-282 0.61 Oc1nc2ccccc2c(=O)n1CC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-7766639274 0.61 C12C(C)=C3OC(CC3=CC=1C(=C(C)C(=O)O2)C)C
MolPort-003-023-761 0.61 O=C(Nc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2)C1CC1
MolPort-046-598-058 0.61 O=C(NC(=S)N1C[C@@H]2CC(C1)c1cccc(=O)n1C2)c1ccc2OCOc2c1
MCULE-2572521776 0.61 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(C=2)OC(C)C(=O)OC(C)C)C1=O
MolPort-000-802-439 0.61 COc1ccc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C2=O)c2ccccc2)cc1OC
MolPort-039-194-087 0.61 O=C(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccc2OCOc2c1
MCULE-4154783301 0.61 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(OCC(OCC(C)C)=O)C=2)C1=O
MolPort-019-629-736 0.61 Clc1ccc(Cl)c(NC(=O)CSC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)c1
MolPort-027-848-780 0.61 Brc1ccc2c([nH]nc2c1)N1CC(CC1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-8147362651 0.61 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC(=C(OC(=O)OC3C=CC=CC=3)C=2)CCCCCC)C1=O
MolPort-001-743-541 0.61 O=C(N1C[C@@H]2C[C@H](C1)c1ccc(C3CCCCC3)c(=O)n1C2)c1cccs1
MolPort-027-718-796 0.61 CCNC(=O)c1ccc(N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c(NC(=O)C(=O)OCC)c1
MCULE-7555688289 0.61 C1(=O)C(C2C=CC(=CC=2)OC2OC(CO)C(C(O)C2O)O)=COC2C=C(OCCCCCCCC)C=C(O)C1=2
MolPort-042-603-096 0.61 CC(O)(CN1CCCC(C1)c1ccccn1)C(F)(F)F
MolPort-008-347-825 0.61 CC(C)C(=O)Nc1ccc2c(c[nH]c2c1)C(N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(O)=O
MCULE-4452841195 0.61 C1(C2C=CC(=CC=2)C2=CC=CC=C2)=C(C)OC2C(=CC=C(OCC)C=2)C1=O
MolPort-001-743-542 0.61 O=C(N1C[C@@H]2C[C@H](C1)c1ccc(C3CCCCC3)c(=O)n1C2)c1ccco1
MolPort-027-718-530 0.61 Brc1ccc2c(n[nH]c2c1)N1CC(CC1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-8382402528 0.61 C1(=O)C(C2C=CC(=CC=2)OCC2C=CC(=CC=2)F)=COC2=CC(OCC3C=CC(=CC=3)F)=CC(OCC3=CC=C(C=C3)F)=C12
MolPort-001-744-079 0.61 COc1ccccc1NC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)C1CCCCC1
MolPort-046-596-720 0.61 COc1ccc2[nH]c3c(ncnc3c2c1)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-6781228005 0.61 C1(C2=CC=C3C(OCCCO3)=C2)=C(C)OC2C(=CC(=C(OCC3C=CC(=CC=3)OC)C=2)CCC)C1=O
MolPort-001-744-946 0.61 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3cccnc3)Cn2c1=O)C1CCCCC1
MolPort-046-564-548 0.61 O=C(N1CCOCC1)c1ccc(nc1)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-7756705453 0.61 C1(=O)C2C=C(CC)C(=CC=2OC(C)=C1C1=CC=C(C=C1)F)OC
MolPort-046-179-097 0.61 CNC(=O)c1ccc(cc1)S(=O)(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-042-630-712 0.61 O=C(NCCc1cccc(=O)[nH]1)C1(CCCCC1)N1CCCCC1
MCULE-6261465547 0.61 C1(=O)OC2=CC(=CC=C2C=C1C1C=CC(=CC=1)OC)OCC(=O)OC(C)(C)C
MolPort-001-743-257 0.61 O=C(Nc1ccccc1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc4ccccc4c3)c(=O)n1C2
MolPort-044-431-361 0.61 COc1ccc(cc1)C(NC(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O)C(C)C
MCULE-9745407672 0.61 C1(C2=CC=CC=C2)=C(C)OC2C(=CC=C(OCC(O)=O)C=2)C1=O
MolPort-001-744-346 0.61 O=C(COc1ccccc1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccccc1
MolPort-046-066-144 0.61 COc1ccc(cc1)C(NC(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O)C(C)C
MCULE-4857649752 0.61 C1(=O)C(C2C=CC(=CC=2)O)=COC2C=C(O)C=C(O)C1=2
MolPort-001-743-556 0.61 Clc1ccc(\C=C\c2ccc3[C@@H]4C[C@@H](CN(C4)C(=O)c4ccccc4)Cn3c2=O)cc1
MolPort-002-515-425 0.61 Cc1ccc2[nH]c(C(O)=O)c(NC(=O)CN3C[C@H]4C[C@H](C3)c3cccc(=O)n3C4)c2c1
MCULE-3197702483 0.61 C1(C2=CC=C(C=C2)Br)=COC2C(=CC=C(OCC3C=CC=CC=3)C=2)C1=O
MolPort-044-566-752 0.61 FC(F)(F)c1ccc2sc(cc2c1)C(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-000-805-478 0.61 O=C(Nc1ccc(OCc2ccccc2)cc1)[C@H](Cc1ccccc1)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-3806916824 0.61 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(OCC3C=C(C)C=CC=3C)C=2)C1=O
MolPort-001-743-255 0.61 OC(=O)COCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc4ccccc4c3)c(=O)n1C2
MolPort-000-811-033 0.61 COc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(O)c(OC)c2)C1=O
MCULE-6069023631 0.61 C1(C2=CC=C(C=C2)OC)=C(C)OC2C(=CC=C(OCC(OCC)=O)C=2)C1=O
MolPort-001-742-969 0.61 CC(=O)c1ccc(NC(=O)Nc2ccc3[C@@H]4C[C@@H](CN(C4)C(=O)NC4CCCCC4)Cn3c2=O)cc1
MolPort-039-194-015 0.61 Fc1ccc2[nH]c3CCN(Cc3c2c1)C(=O)CN1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-1709922645 0.61 C1(C2=CC=C(C(OC)=C2)OC)=COC2C(=CC=C(OCC(OCC)=O)C=2)C1=O
MolPort-001-745-160 0.61 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(NC(=O)Nc3cccc(F)c3)ccc(=O)n1C2
MolPort-044-544-023 0.61 COc1ccc2n(CCC(=O)N3CC4C[C@@H](C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc2c1
MCULE-7250230038 0.61 C1(C2=CC=C(C(OC)=C2)OC)=CC2=CC=C(C=C2OC1=O)OCC(=O)C1C=CC(=CC=1)OC
MolPort-038-432-282 0.61 Oc1nc2ccccc2c(=O)n1CC(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-035-873-254 0.61 COCCn1cc(C(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c2cc(Cl)ccc12
MCULE-7381227555 0.61 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC=C(O)C=2)C1=O
MolPort-001-743-584 0.61 CSCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccc(c3)C#N)c(=O)n1C2
MolPort-044-563-948 0.61 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCc1nc2ccccc2[nH]1
MCULE-8602985340 0.61 C1(=O)OC2=CC(=CC=C2C=C1C1=CC=CC=C1)OC(CC)=O
MolPort-003-023-758 0.61 CCCCC(=O)Nc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-039-056-081 0.61 COc1ccc(cc1)-c1n[nH]cc1C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-9358088710 0.61 C1(C2C=CC=CC=2OC)=C(C)OC2C(=CC=C(OCC(=O)C3C=CC(=CC=3)Br)C=2)C1=O
MolPort-002-518-943 0.61 Fc1ccc(NC(=O)[C@H](Cc2ccccc2)NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1Cl
MolPort-035-873-296 0.61 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cc(n[nH]1)-c1ccccc1
MCULE-7653883404 0.61 C1(=O)OC2=CC(=CC=C2C=C1C1=CC=CC=C1)OC(C(C)C)=O
MolPort-001-744-022 0.61 CSc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)NC3CCCCC3)c12
MolPort-035-372-433 0.61 COc1cccc2C=C(CN3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)COc12
MCULE-8805317880 0.61 C1(C2=CC=CC=C2)=COC2C(=CC=C(OCC3=CC=CC=C3C)C=2)C1=O
MolPort-003-023-762 0.61 O=C(Nc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2)C1CCCC1
MolPort-028-738-482 0.61 CC(C)c1nc2cc(ccc2o1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-1787148508 0.61 C1(=O)OC2=CC(OCC)=CC=C2C=C1C1C=CC(=CC=1)OC
MolPort-042-579-019 0.61 CC(N1CCCCC1)C(=O)NCCc1cccc(=O)[nH]1
MolPort-044-632-808 0.61 Clc1ccc(CNC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)s1
MCULE-4281666458 0.61 C1(=O)OC2=CC(=CC=C2C=C1C1=CC=C(C=C1)OC)OCC(OC(C)C)=O
MolPort-007-922-989 0.61 Fc1ccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3ccccc3Br)c2)cc1F
MolPort-046-597-637 0.61 COc1ccc(cc1)-c1[nH]ncc1C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-2809736615 0.61 C1(=O)OC2=CC(=CC=C2C=C1C1C=CC=CC=1)OCC(C)=O
MolPort-007-981-022 0.61 O=C(Nc1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)C#N)c1ccco1
MolPort-046-597-418 0.61 COCCn1cc(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2cc(Cl)ccc12
MCULE-9941356564 0.61 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(C=2)OC(CC)C(OCC)=O)C1=O
MolPort-007-922-987 0.61 Fc1ccccc1NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccccc2Cl)c1
MolPort-021-764-223 0.61 O=C(Cn1ccccc1=O)N1CC[C@@H]2[C@@H](CCC(=O)N2CCc2ccccn2)C1
MCULE-6244389880 0.61 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(C=2)OC(CC)C(OCCC)=O)C1=O
MolPort-044-544-094 0.61 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)CC3(Cn4cnnn4)CCCCC3)Cn2c1=O
MolPort-030-062-164 0.61 Cc1cc(C)cc(c1)C1(CNC(=O)CCn2c(C)cccc2=O)CCCC1
MCULE-3670130565 0.61 C1(C(F)(F)F)OC2=CC(OCCC3C=CC=CC=3)=CC=C2C(=O)C=1C1=CC=C(C(OC)=C1)OC
MolPort-007-981-024 0.61 COc1ccc(cc1OC)C(=O)Nc1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)C#N
MolPort-042-579-019 0.61 CC(N1CCCCC1)C(=O)NCCc1cccc(=O)[nH]1
MCULE-8149516497 0.61 C1(=O)C(C2=CC=C(C=C2)OC)=C(C)OC2=CC(OC(C)=O)=CC(OC(C)=O)=C12
MolPort-007-931-406 0.61 FC(F)(F)c1cccc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCCc2ccccc2)c1
MolPort-044-544-094 0.61 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)CC3(Cn4cnnn4)CCCCC3)Cn2c1=O
MCULE-7130073684 0.61 C1(=O)C(C2C=CC(=CC=2)OCC2=CC=C(C=C2)Cl)=COC2=CC(OCC3=CC=C(C=C3)Cl)=CC(OCC3C=CC(=CC=3)Cl)=C12
MolPort-007-921-179 0.61 CCN(CC)c1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)NCc1ccccc1OC
MolPort-044-810-674 0.61 CCOC(=O)N1CCN(CC1)C(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MCULE-2762014060 0.61 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(C=2)OC(=O)C2CC2)C1=O
MolPort-007-923-093 0.61 CC1CN(CCN1c1cccc(C)c1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccccc2Br)c1
MolPort-046-597-954 0.61 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H]([C@@H]3[C@@H](Cc2c1)C(=O)NCCCc1ccco1)c1cccc(=O)n1C4
MCULE-8086818214 0.61 C1(=O)C2C=C(CC)C(=CC=2OC(C)=C1C1C=CC(=CC=1)F)OCC1C=CC=CC=1
MolPort-007-921-193 0.61 Fc1ccc(cc1)N1CCN(CC1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(F)cc2)c1
MolPort-044-179-496 0.61 CC(C)n1ccc2ccc(cc12)C(=O)N1C[C@@H]2CC(C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MCULE-3100252885 0.61 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OCC3=CC(=O)OC4C=C(C)C=C(C)C=43)C=2)CCC)C1=O
MolPort-001-743-001 0.61 COc1ccc(cc1)S(=O)(=O)Nc1ccc2[C@@H]3C[C@@H](CN(CC4CCCCC4)C3)Cn2c1=O
MolPort-044-566-764 0.61 O=C(COc1ccc2CCC(=O)Nc2c1)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-4923185285 0.61 C1(C2C=CC=CC=2)=COC2C(=CC=C(C=2)OC(=O)C2=CC=C(C=C2)C(C)(C)C)C1=O
MolPort-001-745-093 0.61 CSCC(=O)Nc1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)NC3CCCCC3)c12
MolPort-042-629-398 0.61 Cn1cncc1-c1cccc(c1)C(=O)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-4507175068 0.61 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(OCC=C)C=2)C1=O
MolPort-007-920-821 0.61 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)NCCCN1CCOCC1
MolPort-042-603-096 0.61 CC(O)(CN1CCCC(C1)c1ccccn1)C(F)(F)F
MCULE-8332257866 0.61 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(OCC(OCCC)=O)C=2)C1=O
MolPort-019-555-927 0.61 CC(SC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(Oc2ccccc2)cc1
MolPort-046-597-460 0.61 Cn1ncc(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1-n1cccc1
MCULE-4753612859 0.61 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(C=2)OC(C)C(=O)OC(C)CC)C1=O
MolPort-001-743-815 0.61 COc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)NC3CCCCC3)c12
MolPort-044-431-335 0.61 COc1ccc2n(CCC(=O)N3C[C@@H]4CC(C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc2c1
MCULE-5654052063 0.61 C1(C2C=CC(=CC=2)OC)=COC2=C(C=CC(OC(CCCCCN)=O)=C2)C1=O.Br
MolPort-007-920-996 0.61 COc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(OC(F)(F)F)cc1
MolPort-035-873-481 0.61 Cn1ncc(C(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c1-n1cccc1
MCULE-4533374263 0.61 C1(C2=CC=CC=C2OC)=COC2C(=CC=C(OCC(=O)OC3CCCCC3)C=2)C1=O
MolPort-001-744-111 0.61 Clc1ccc(\C=C\c2ccc(=O)n3C[C@H]4C[C@H](CN(C4)C(=O)NC4CCCCC4)c23)cc1
MolPort-044-544-567 0.61 COc1c[nH]c(cc1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-4721861322 0.61 C1(=O)OC2=CC(=CC=C2C=C1C1=CC=C(C=C1)OC)OC(C)C(OC)=O
MolPort-007-921-170 0.61 COCCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(F)cc2)c1
MolPort-046-597-796 0.61 COc1ccc2n(CCC(=O)N3C[C@@H]4C[C@@H](C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc2c1
MCULE-4093743864 0.61 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(C=2)OC(C)C(OCCCC)=O)C1=O
MolPort-044-810-674 0.61 CCOC(=O)N1CCN(CC1)C(=O)[C@@H]1Cc2cc(ccc2N2C[C@@H]3C[C@@H](Cn4c3cccc4=O)[C@@H]12)[N+]([O-])=O
MolPort-044-565-907 0.61 Oc1nc2ccccc2c(=O)n1CC(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-1045072536 0.61 C1(=O)OC2=CC(=CC=C2C=C1C1C=CC=CC=1)OCC(C)=C
MolPort-046-597-954 0.61 CC(=O)Nc1ccc2N3C[C@H]4C[C@@H]([C@@H]3[C@@H](Cc2c1)C(=O)NCCCc1ccco1)c1cccc(=O)n1C4
MolPort-046-597-461 0.61 Oc1nc2ccccc2c(=O)n1CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-5915086515 0.61 C1(C2=CC=C3C(OCO3)=C2)=COC2=C(C=C(C(O)=C2)CC)C1=O
MolPort-044-563-948 0.61 [O-][N+](=O)c1ccc2N3C[C@H]4C[C@@H](Cn5c4cccc5=O)[C@H]3[C@@H](Cc2c1)C(=O)NCc1nc2ccccc2[nH]1
MolPort-046-423-520 0.61 COc1ccc2n(CCC(=O)N3C[C@H]4C[C@@H](C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc2c1
MCULE-3862000587 0.61 C1(C2=CC=C3C(OCCCO3)=C2)=C(C)OC2C(=CC(=C(OCC(C)=C)C=2)CC)C1=O
MolPort-001-743-169 0.61 OC(=O)C(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)NC3CCCCC3)c(=O)n1C2
MolPort-035-874-280 0.61 O=C(Nc1ccccc1C(=O)NCc1ccccn1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-7562188106 0.61 C12C(OC)=CC3=C(C(CC(=O)O3)C3C=C(OC)C(=CC=3OC)OC)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-001-743-813 0.61 COc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)CCC(O)=O)c12
MolPort-001-744-526 0.61 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccn3)Cn2c1=O)c1ccncc1
MCULE-7319103282 0.61 C1(C2=CC=C3C(OCCO3)=C2)=COC2=C(C=CC(OCC(O)=O)=C2)C1=O
MolPort-001-744-102 0.61 Clc1ccc(\C=C\c2ccc(=O)n3C[C@H]4C[C@H](CN(C4)C(=O)c4ccccc4)c23)cc1
MolPort-000-811-064 0.61 COc1ccc(CC2(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(=O)NC(=O)N(C2=O)c2ccccc2)c(OC)c1
MCULE-8233254265 0.61 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(OCC(OCCCCC)=O)C=2)C1=O
MolPort-001-743-026 0.61 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(C3)c3ncccn3)Cn2c1=O)c1ccccc1
MolPort-007-922-607 0.61 CC(C)(C)c1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)NCc1cccc(Cl)c1
MCULE-8999196013 0.61 C12C(OC)=CC3=C(C(C4=CC=C(C=C4)C(OC)=O)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-007-922-623 0.61 [O-][N+](=O)c1cc(ccc1N1CCN(CC1)c1ccc(F)cc1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-007-920-862 0.61 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCN(CC1)c1ccc(F)cc1
MCULE-6202652357 0.61 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OC(=O)C3=CC=CC=C3OC)C=2)CCC)C1=O
MolPort-001-744-389 0.61 COCCC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccc4ccccc4c3)Cn2c1=O
MolPort-009-759-279 0.61 CC(C)Oc1ccc(cc1)C(=O)Nc1ccc(nc1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-6002662050 0.61 C12=CC3CCC(OC=3C(C)=C1OC(=O)C=C2C1C=CC=CC=1)(C)C
MolPort-001-743-141 0.61 O=C(COc1ccccc1)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)COc3ccccc3)Cn2c1=O
MolPort-004-387-113 0.61 C(Cc1ccccn1)NC1CCC(CC1)c1ccccc1
MCULE-7133606865 0.61 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OCC=CC3C=CC=CC=3)C=2)CC)C1=O
MolPort-019-635-497 0.61 Cc1ccc(Cl)cc1NC(=O)CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-002-771-562 0.61 CN(CCc1ccccn1)C1CCC(CC1)c1ccccc1
MCULE-7777311089 0.61 C1(C2C=CC3=C(OCCO3)C=2)=COC2=C(C=CC(OCC(OC)=O)=C2)C1=O
MolPort-009-745-140 0.61 Cc1c(cnn1-c1ccccc1)C(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MolPort-046-595-490 0.61 O=C(Nc1ccc2OCCCOc2c1)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-4475551410 0.61 O1[C@H](CC2=CC3C=CC(=O)OC=3C=C12)C(C)(C)OC(=O)C(C)=CC
MolPort-005-946-366 0.61 CN(C)CC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccn3)Cn2c1=O
MolPort-001-743-711 0.61 COc1ccc(CN2C[C@@H]3C[C@H](C2)c2ccc(-c4ccc(SC)cc4)c(=O)n2C3)cc1
MCULE-8399739078 0.61 C12C(OC)=CC3=C(C(C4C=CC(=CC=4)SC)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-001-743-430 0.61 COCCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(OC(F)(F)F)cc3)c(=O)n1C2
MolPort-029-885-008 0.61 COc1ccccc1CN1C(=O)N[C@@H](CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C1=O
MCULE-6356670157 0.61 C1(C2C=CC(=CC=2)OC)=COC2=C(C=C(C(OC)=C2)OC)C1=O
MolPort-002-511-716 0.61 C=CCN1C(=O)NC(=O)C(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc3OCOc3c2)C1=O
MolPort-005-946-344 0.61 CCCS(=O)(=O)Nc1ccc2[C@@H]3C[C@@H](CN(Cc4ccc(F)cc4)C3)Cn2c1=O
MCULE-7291287913 0.61 C12OC=C(C(=O)C1=CC=C(O)C=2C(CC(OC)=O)C1C=CC(=C(OC(C)C)C=1)OC)C1=CC=C(C=C1)O
MolPort-045-968-535 0.61 Clc1cccc(c1)-c1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)o1
MolPort-001-745-140 0.61 COc1ccccc1NC(=O)Nc1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C3CCN(C)CC3)c12
MCULE-4084612980 0.61 O1[C@H](CC2=CC3C=CC(=O)OC=3C=C12)C(C)(C)OC(C1C=CC=CC=1)=O
MolPort-000-838-894 0.61 COc1ccc(cc1)-c1cn[nH]c1-c1ccc(OCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc1O
MolPort-001-743-386 0.61 Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccc(cc3)C#N)Cn2c1=O
MCULE-6619495454 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=C(C=3)OCC(N)=O)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-046-595-408 0.61 Cc1c(C)c(=O)oc2c(CN3CC4CC(C3)c3cccc(=O)n3C4)c(O)ccc12
MolPort-001-743-180 0.61 COCCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)Nc3ccccc3)c(=O)n1C2
MCULE-3590562126 0.61 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(OCCN3CCOCC3)C=2)C1=O
MolPort-046-489-585 0.61 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1cn2CCCCc2n1
MolPort-046-597-460 0.61 Cn1ncc(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1-n1cccc1
MCULE-6975333533 0.61 C12OC=C(C(=O)C1=CC=C(O)C=2C(C1C=CC(=CC=1)C)CC(OC)=O)C1=CC=C(C=C1)O
MolPort-044-566-238 0.61 COc1cnc(cc1O)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-431-335 0.61 COc1ccc2n(CCC(=O)N3C[C@@H]4CC(C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc2c1
MCULE-4813369836 0.61 C12C(O)=CC3=C(C(C4C=CN=CC=4)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-001-744-585 0.61 Fc1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2ccc(NC(=O)Nc4ccccc4)c(=O)n2C3)cc1
MolPort-046-597-461 0.61 Oc1nc2ccccc2c(=O)n1CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-1106015163 0.61 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(OCCN3CCN(CC3)CCO)C=2C)C1=O
MolPort-046-779-407 0.61 O=C(N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)c1ccc2cn[nH]c2n1
MolPort-001-744-925 0.61 O=C(N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccccc1)c1cncnc1
MCULE-3059394382 0.61 C12OC=C(C(=O)C1=CC=C(O)C=2C(C1C=CC(=CC=1)O)CC(OC)=O)C1=CC=C(C=C1)O
MolPort-001-744-356 0.61 O=C(Nc1ccccc1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccccc1
MolPort-001-744-018 0.61 CSCC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc(SC)cc1
MCULE-9474592036 0.61 C1(=O)C(C2=CC=C(C(OC)=C2)OC)=COC2=CC(O)=CC(OC)=C12
MolPort-000-835-008 0.61 Oc1cc(OCCN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)ccc1-c1[nH]ncc1-c1ccccc1
MolPort-007-922-984 0.61 Fc1ccccc1NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2cccc(c2)C(F)(F)F)c1
MCULE-1116090778 0.61 C12C(O)=CC3=C(C(CC(=O)O3)C3C=C(OC)C(=CC=3OC)OC)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-000-857-045 0.61 Brc1ccc2oc(cc2c1)C(=O)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-007-921-274 0.61 CCN(CC)c1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccccc1SC
MCULE-6335474568 0.61 C1(C2=CC=C3C(OCCO3)=C2)=C(CC)OC2=C(C=C(C(OCC(OC)=O)=C2)CC)C1=O
MolPort-027-846-724 0.60 Oc1nc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)nc2ccsc12
MolPort-040-560-682 0.60 CC1CC1c1nnc2ccc(nn12)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-044-431-373 0.60 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)COc3ccccc3)Cn2c1=O
MolPort-039-080-293 0.60 CC(C)(C)N1CC(CC1=O)NC(Cc1ccccn1)C1CC1
MolPort-044-543-596 0.60 CSCC[C@@H](C(=O)N1C[C@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2)n1cccc1
MolPort-038-432-231 0.60 COc1ccc(cc1)-c1[nH]nc(C)c1CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-744-261 0.60 COc1ccc(CN2C[C@@H]3C[C@H](C2)c2c(ccc(=O)n2C3)-c2ccc(SC)cc2)cc1
MolPort-039-193-993 0.60 CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(Br)s2)C1=O
MolPort-000-778-459 0.60 CCOc1cc(CC2(CN3CC4CC(C3)c3cccc(=O)n3C4)C(=O)N(C)C(=S)N(C)C2=O)cc(Br)c1O
MolPort-002-536-146 0.60 Clc1ccc2oc(cc2c1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-001-744-912 0.60 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccs3)c(=O)n1C2
MolPort-030-042-381 0.60 COC(=O)c1cc(NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)ccc1F
MolPort-007-901-254 0.60 CCOc1ccc(\C=N\NC(=O)Cc2ccccc2)cc1CN1CC2CC(C1)c1cccc(=O)n1C2
MolPort-005-946-317 0.60 O=C(N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cccc(c1)C#N)c1ccncc1
MolPort-001-743-841 0.60 O=C(Nc1ccccc1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc2ccccc2c1
MolPort-001-744-537 0.60 O=C(Nc1ccccc1)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccn3)Cn2c1=O
MolPort-001-743-986 0.60 CN(C)CC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc(OC(F)(F)F)cc1
MolPort-035-873-682 0.60 COCCn1c(cc2cc(Cl)ccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-000-838-818 0.60 [O-][N+](=O)c1ccc(cc1)C(=O)NC(NC(=S)N1C[C@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MolPort-027-718-213 0.60 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCN(Cc2ccccc2Cl)CC1
MCULE-5757582648 0.60 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(C=2)OC(C)C(OCCOCC)=O)C1=O
MolPort-046-768-545 0.60 Cl.COC(=O)c1ccc(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)o1
MCULE-9666067416 0.60 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OCC3=CC(=O)OC4C=C(OC)C=CC=43)C=2)CC)C1=O
MolPort-001-743-476 0.60 COc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccnc3)c(=O)n1C2
MCULE-2811561827 0.60 C1(C2=CC=C(C(OC)=C2)OC)=COC2C(=CC=C(OC)C=2)C1=O
MolPort-027-718-104 0.60 COC(=O)c1cc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)ccc1F
MCULE-8255031461 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3=CC(OC)=C(C(OC)=C3)O)C=1OC=C(C1=CC=CC=C1OC)C2=O
MolPort-046-595-483 0.60 [O-][N+](=O)c1ccc2C3CC(CN(C3)C(=O)COc3ccccc3)Cn2c1=O
MCULE-9937066723 0.60 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(OC(CCC3CCCC3)=O)C=2)C1=O
MolPort-039-194-031 0.60 CCOc1cc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=S)N(C)C2=O)cc(Br)c1O
MCULE-2356928647 0.60 C1(=O)OC2=CC(=CC=C2C=C1C1C=CC(=CC=1)OC)OCC(OC)=O
MolPort-044-431-373 0.60 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)COc3ccccc3)Cn2c1=O
MCULE-1386079209 0.60 C1(C2=CC=C3C(OCCCO3)=C2)=C(C)OC2C(=CC(=C(OCC(N)=O)C=2)CCC)C1=O
MolPort-044-565-534 0.60 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)Cn3ccc4ccc(Cl)cc34)Cn2c1=O
MCULE-6820905640 0.60 C12OC=C(C(=O)C=1C=CC1OC(CC(C3=CC=CC=C3OCC(OC)=O)C2=1)=O)C1=CC=C(C(OC)=C1)OC
MolPort-044-179-909 0.60 CCCCc1cc(=O)oc2c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c(O)ccc12
MCULE-8779714864 0.60 C1(=O)C(C2=CC=C(C=C2)OCC2C(=CC=CC=2Cl)Cl)=COC2=CC(OCC3C(=CC=CC=3Cl)Cl)=CC(OCC3C(=CC=CC=3Cl)Cl)=C12
MolPort-044-544-301 0.60 [O-][N+](=O)c1ccc2[C@@H]3C[C@H](CN(C3)C(=O)Cc3c[nH]c4ccccc34)Cn2c1=O
MCULE-7265814087 0.60 C1(=O)OC2=CC(=CC=C2C=C1C1=CC=CC=C1)OC(C)C(OC)=O
MolPort-044-180-372 0.60 CCCc1cc(=O)oc2c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c(O)ccc12
MCULE-1430573532 0.60 C1(=O)OC2=CC(OCC)=CC=C2C=C1C1C=CC=CC=1
MolPort-044-180-389 0.60 [O-][N+](=O)c1ccc2C3C[C@@H](CN(C3)C(=O)Cn3ccc4ccc(Cl)cc34)Cn2c1=O
MCULE-4151044289 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC4=C(OCO4)C=3)C=1OC=C(C1=CC=CC=C1)C2=O
MolPort-044-544-276 0.60 [O-][N+](=O)c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)COc3ccccc3)Cn2c1=O
MCULE-3140099744 0.60 C1(C2=CC=C(C(OC)=C2)OC)=COC2C(=CC=C(OCC#N)C=2)C1=O
MolPort-046-424-575 0.60 OC(=O)Cn1cc(C(N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(O)=O)c2ccccc12
MCULE-1185122173 0.60 C1(C2C=CC(=CC=2)OC)=C(C)OC2C(=CC=C(OCCBr)C=2)C1=O
MolPort-044-810-694 0.60 COc1ccc(CC(=O)N2C[C@H]3C[C@H](C2)c2ccc([N+]([O-])=O)c(=O)n2C3)cc1OC
MCULE-6603122659 0.60 C1(C2C=CC(=CC=2)OC)=C(C)OC2C(=CC=C(OC)C=2)C1=O
MolPort-046-424-499 0.60 COc1ccc(CCC(=O)N2C[C@H]3C[C@@H](C2)c2ccc([N+]([O-])=O)c(=O)n2C3)cc1OC
MCULE-3445810202 0.60 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(OCCN3CC(C)OC(C)C3)C=2)C1=O
MolPort-002-516-092 0.60 COc1ccc(cc1)C(=O)NC(NC(=S)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MCULE-7433579320 0.60 C1(C2C=CC=CC=2)=COC2C(=CC=C(OCCN3CCOCC3)C=2)C1=O
MolPort-035-873-807 0.60 COc1ccc(cc1)-c1n[nH]c(C)c1CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-5986511953 0.60 C1(C2=CC=C(C=C2)Br)=COC2C(=CC=C(OCC3C=CC(=CC=3)C)C=2)C1=O
MolPort-039-194-176 0.60 OC(=O)Cn1cc(C(N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)C(O)=O)c2ccccc12
MCULE-2985020036 0.60 C1(C2=CC=C(C=C2)Br)=C(C)OC2C(=CC=C(OC(CC)=O)C=2)C1=O
MolPort-046-751-507 0.60 Cc1cccc(CCN2CCC(Cc3ccc(=O)[nH]c3)CC2)n1
MCULE-9606407804 0.60 C1(C2C=CC(=CC=2)Br)=C(C)OC2C(=CC=C(C=2)OC(=O)C(C)(C)C)C1=O
MolPort-007-921-139 0.60 CCN(C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2cc(OC)cc(OC)c2)c1)c1cccc(C)c1
MCULE-3953125819 0.60 [C@H]1(CO)O[C@@H](OC2C=C3OC=C(C4C=CC(O[C@@H]5O[C@H](CO)[C@@H](O)[C@H](O)[C@H]5O)=CC=4)C(=O)C3=C(O)C=2)[C@H](O)[C@@H](O)[C@@H]1O
MolPort-044-566-639 0.60 COc1cccc2n(CCC(=O)N3C[C@H]4C[C@@H](C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc12
MCULE-1383159170 0.60 C1(C2=CC=C(C=C2)Br)=COC2C(=CC=C(OCC(N)=O)C=2)C1=O
MolPort-019-813-851 0.60 CC(C)CN1CCC(CC1)NC(C)Cc1ncccc1C
MCULE-9312721898 0.60 C12O[C@H](C(C)(C)O[C@H]3[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O3)CC=1C(OC)=C1C(=O)C=C(CO)OC1=C2
MolPort-039-080-293 0.60 CC(C)(C)N1CC(CC1=O)NC(Cc1ccccn1)C1CC1
MCULE-1445635306 0.60 C1(C2C=CC(=CC=2)Br)=C(C)OC2C(=CC=C(C=2)OC(C)C(OC)=O)C1=O
MolPort-046-751-507 0.60 Cc1cccc(CCN2CCC(Cc3ccc(=O)[nH]c3)CC2)n1
MCULE-6289956605 0.60 C1(C2=CC=C(C(OC)=C2)OC)=COC2C(=CC=C(OCCBr)C=2)C1=O
MolPort-007-923-835 0.60 COc1cccc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(O)=O)c1
MCULE-5904592270 0.60 C1(C2C=CC(=CC=2)Br)=C(C)OC2C(=CC=C(OCC)C=2)C1=O
MolPort-007-921-017 0.60 CCOC(=O)N1CCC(CC1)NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(cc2)N(CC)CC)c1
MCULE-2865448265 0.60 C1(C2C=CC(=CC=2)Br)=C(C)OC2C(=CC=C(OCC(C)=C)C=2)C1=O
MolPort-007-921-263 0.60 Cc1ccc(Cl)cc1NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccncc2)c1
MCULE-6273790830 0.60 C1(C2=CC=CC=C2)=C(C)OC2C(=CC=C(C=2)OC(=O)C2CC2)C1=O
MolPort-007-921-037 0.60 Cc1cccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3ccc(F)cc3)c2)n1
MCULE-3724046188 0.60 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(OC(C)=O)C=2)C1=O
MolPort-007-931-477 0.60 Clc1ccc(NC(=O)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NC2CC2)cc1
MCULE-2809671108 0.60 C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO[C@H]3[C@H](O)[C@H](O)[C@@H](O)[C@H](C)O3)O2)C=C2OC=C(C3C=CC(O)=CC=3)C(=O)C2=C(O)C=1
MolPort-007-931-474 0.60 Clc1ccc(NC(=O)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCCc2ccccc2)cc1
MCULE-6295893482 0.60 C1(C2C=CC(=CC=2)OC)=C(C)OC2C(=CC=C(OC(C)=O)C=2)C1=O
MolPort-007-920-874 0.60 Cc1ccc(Cl)cc1NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(c1)[N+]([O-])=O
MCULE-6216900488 0.60 C1(C2=CC=C3C(OCCO3)=C2)=C(C)OC2=C(C=C(C(OCC3C=CC(=CC=3)F)=C2)CCC)C1=O
MolPort-007-923-120 0.60 Clc1ccccc1C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCN(CC1)c1ccccc1
MCULE-1855254877 0.60 C1(C2=CC=C3C(OCCCO3)=C2)=COC2C(=CC(=C(OCC3=CC=C(C=C3)F)C=2)CC)C1=O
MolPort-007-931-465 0.60 CC(C)CCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)Nc2ccc(Cl)cc2)c1
MCULE-2737661892 0.60 C1(C2=CC=C(OC)C=C2)C(=O)OC2C(=C(OC)C=C(OC)C=2)C=1O
MolPort-007-931-448 0.60 Clc1ccc(NC(=O)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCc2ccccc2)cc1
MCULE-5597766264 0.60 C1(C2=CC=C3C(OCCO3)=C2)=C(C)OC2C(=CC(=C(OCC3C=CC=CC=3F)C=2)CCC)C1=O
MolPort-007-922-592 0.60 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCCc2ccccc12
MCULE-3931797737 0.60 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OC(=O)C3=CC=CC=C3C)C=2)CC)C1=O
MolPort-001-744-016 0.60 CSc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)c3ccncc3)c12
MCULE-3934074243 0.60 C1(C2=CC=C(C=C2)Cl)=COC2C(=CC=C(OCC#N)C=2)C1=O
MolPort-007-932-530 0.60 COCCCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=S)Nc2ccc(C)cc2)c1
MolPort-007-923-122 0.60 Fc1cccc(F)c1C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCN(CC1)c1ccccc1
MCULE-6847395929 0.60 C1(C2=CC=C3C(OCCCO3)=C2)=COC2C(=CC(=C(OCC3C=CC=CC=3Cl)C=2)CC)C1=O
MolPort-040-560-682 0.60 CC1CC1c1nnc2ccc(nn12)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MolPort-007-920-922 0.60 COc1cc(OC)cc(c1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1cccc(c1)C(C)=O
MCULE-6287861297 0.60 C1(C2=CC=C3C(OCCCO3)=C2)=COC2C(=CC(=C(OCC3C=CC(=CC=3)Cl)C=2)CC)C1=O
MolPort-007-921-123 0.60 Fc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCc2ccccc2C1
MolPort-003-057-431 0.60 COc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCN(CC1)C(C)=O
MCULE-4013986355 0.60 C1(=O)OC2=CC(=CC=C2C=C1C1C=CC(=CC=1)OC)OCC(OCC)=O
MolPort-019-556-014 0.60 [O-][N+](=O)c1cccc(NC(=O)CSC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)c1
MolPort-007-932-537 0.60 Cc1ccc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCc2ccc(F)cc2)cc1C
MCULE-7071226808 0.60 C12OC(C)(C)C=CC1=C1OC=C(C3C=CC(O)=CC=3)C(=O)C1=C(O)C=2
MolPort-001-743-433 0.60 FC(F)(F)Oc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)NC3CCCCC3)Cn2c1=O
MolPort-007-921-113 0.60 CCOc1ccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3ccc(F)cc3)c2)cc1
MCULE-4886963828 0.60 C1(C2=CC=C3C(OCCCO3)=C2)=COC2C(=CC(=C(OCC3=CC=CC(Cl)=C3)C=2)CC)C1=O
MolPort-001-745-134 0.60 CN1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(NC(=O)c3cnccn3)ccc(=O)n1C2
MolPort-007-923-021 0.60 Clc1ccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3cccnc3)c2)cc1
MCULE-1820272757 0.60 C1(C2=CC=C3C(OCCCO3)=C2)=C(C)OC2C(=CC(=C(OCC3=CC=CC=C3)C=2)CC)C1=O
MolPort-039-193-957 0.60 COc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(OC)c(OC)c2)C1=O
MolPort-007-922-853 0.60 COCCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2cccc(c2)C(F)(F)F)c1
MCULE-2313438377 0.60 C1(C2C=CC=CC=2OC)=C(C)OC2C(=CC=C(OCC(=O)C3C=CC(=CC=3)F)C=2)C1=O
MolPort-002-517-728 0.60 CSCC[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1cc(C)cc(C)c1
MolPort-007-922-933 0.60 COC(=O)c1cc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3ccc(cc3)C(C)(C)C)c2)cc(c1)C(=O)OC
MCULE-4105149473 0.60 C1(C2=CC=C3C(OCCO3)=C2)=C(C)OC2C(=CC(=C(OCC3=CC=CC(OC)=C3)C=2)CC)C1=O
MolPort-019-623-562 0.60 Fc1ccc(NC(=O)CSC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1Cl
MolPort-046-595-488 0.60 [O-][N+](=O)c1ccc2C3CC(CN(C3)C(=O)Cc3c[nH]c4ccccc34)Cn2c1=O
MCULE-4290705490 0.60 C1(O)C=C2OC=C(C3C=C(OC)C=C(O)C=3)C(=O)C2=CC=1
MolPort-039-193-863 0.60 Fc1c(F)c(F)c(Oc2cccc(NC(=O)N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)c2)c(F)c1F
MolPort-005-946-303 0.60 OC(=O)COCC(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc2ccccc2c1
MCULE-5099297649 0.60 C1(C2=CC=C3C(OCCO3)=C2)=C(C)OC2C(=CC(=C(OCC(N)=O)C=2)CC)C1=O
MolPort-002-519-088 0.60 CCc1ccccc1NC(=O)[C@H](CCSC)NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-020-217-711 0.60 C\C=C\Cc1nnc(o1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-9179334950 0.60 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OC(=O)C3=CC=C(C=C3)Cl)C=2)CCC)C1=O
MolPort-001-745-147 0.60 COc1ccccc1C(=O)Nc1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C3CCN(CC3)C(C)=O)c12
MolPort-000-853-063 0.60 O=C(CCc1cn(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c2ccccc12)N1CCOCC1
MCULE-9442132737 0.60 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OCC3=CC=C(C=C3Cl)Cl)C=2)CC)C1=O
MolPort-044-544-589 0.60 Cn1c2ccccc2c(cc1=O)C(=O)N1C[C@@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-006-848-555 0.60 O=c1cccc2C3CC(CN(C3)c3nc(cs3)-c3ccccc3)Cn12
MCULE-1745767828 0.60 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OC(=O)N(C)C)C=2)CC)C1=O
MolPort-007-920-945 0.60 Clc1cccc(CNC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3ccncc3)c2)c1
MolPort-039-194-158 0.60 Clc1ccc2oc(cc2c1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-3466723214 0.60 C1(C2C=CC(=CC=2)OC)=C(C)OC2C(=CC=C(OCC#N)C=2)C1=O
MolPort-007-931-478 0.60 Clc1ccc(NC(=O)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NC2CCCC2)cc1
MolPort-044-564-000 0.60 COc1ccc(cc1)-c1n[nH]c(C)c1CC(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-9729494070 0.60 C1(O[C@H]2[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O2)C=C2OC=C(C3C=CC(OC)=CC=3)C(=O)C2=C(O)C=1
MolPort-007-921-286 0.60 Fc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)N1CCOCC1
MCULE-1363707895 0.60 C1(=O)C(C2C=CC(=CC=2)OCC2=CC=CC(Cl)=C2)=COC2=CC(OCC3=CC=CC(Cl)=C3)=CC(OCC3C=CC=C(Cl)C=3)=C12
MolPort-007-920-838 0.60 Cc1cccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(c2)[N+]([O-])=O)n1
MCULE-4928389866 0.60 C1(=O)C(C2=CC=C(C=C2)OC2OC(CO)C(C(O)C2O)O)=COC2=CC(OC)=CC(O)=C12
MolPort-001-744-405 0.60 O=C(Cc1ccccc1)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccc(cc3)-c3ccccc3)Cn2c1=O
MCULE-4175634173 0.60 C1(O)C=C2OC=C(C3C=CC(O)=CC=3)C(=O)C2=CC=1OC
MolPort-007-922-866 0.60 CCOc1ccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3ccccc3Br)c2)cc1
MCULE-8663203442 0.60 C1(C2=CC=C3C(OCCO3)=C2)=C(C)OC2C(=CC(=C(OCC(OCC=C)=O)C=2)CC)C1=O
MolPort-007-931-469 0.60 Clc1ccc(NC(=O)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)N2CCCC2)cc1
MCULE-2472987581 0.60 C1(C2C=CC3=C(OCCCO3)C=2)=COC2=C(C=CC(OC(C)=O)=C2)C1=O
MolPort-007-931-077 0.60 CCc1ccc(NC(=O)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NCCc2ccc(Cl)cc2)cc1
MCULE-9515120988 0.60 C1(=O)C(C2=CC=C(C=C2)OCC2=CC=CC=C2Cl)=COC2=CC(OCC3=CC=CC=C3Cl)=CC(OCC3C=CC=CC=3Cl)=C12
MolPort-007-922-865 0.60 CCOc1ccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3cccc(c3)C(F)(F)F)c2)cc1
MCULE-7192613088 0.60 C12C(=CC(=C3CCC(C)(C)OC=13)C)OC(C(C)=C2C)=O
MolPort-007-931-480 0.60 Clc1ccc(NC(=O)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NC2CCCCC2)cc1
MCULE-9384614492 0.60 C1(C2=CC=C(C=C2)F)=COC2=C(C=CC(OC(C)=O)=C2)C1=O
MolPort-007-923-054 0.60 CSc1ccccc1NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(cc2)C(C)(C)C)c1
MCULE-3018809144 0.60 C1(C2C(=O)C3C(=CC4OC(C)(C)C=CC=4C=3O)OC=2)=CC=C(O)C=C1
MolPort-007-932-545 0.60 COCCCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=S)Nc2ccc(C)c(C)c2)c1
MCULE-8961311254 0.60 C1(C2=CC=C(C=C2)F)=COC2=C(C=CC(=C2)OC(C(C)N)=O)C1=O
MolPort-007-923-131 0.60 Cc1cccc(NC(=O)c2ccc(N3CC4CC(C3)c3cccc(=O)n3C4)c(NC(=O)c3cccc(c3)C(F)(F)F)c2)n1
MCULE-2597500189 0.60 C1(C2=CC=C(C=C2)Cl)=C(C)OC2C(=CC=C(OCC(=O)C3C=CC(=CC=3)F)C=2)C1=O
MolPort-007-921-232 0.60 COc1ccc(cc1)C(=O)Nc1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(F)c(F)c1
MCULE-3696426569 0.60 C1(C2=CC=C(C=C2)Br)=COC2C(=CC=C(OCC3=CC=C(C=C3)OC)C=2)C1=O
MolPort-007-921-252 0.60 Fc1ccccc1NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)CCN2CCOCC2)c1
MCULE-9391578821 0.60 C1(C2=CC=CC=C2)=C(C)OC2C(=CC=C(OCC(OC)=O)C=2)C1=O
MolPort-007-923-127 0.60 CC1CN(CCN1c1cccc(C)c1)C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2cccc(c2)C(F)(F)F)c1
MCULE-7255046562 0.60 C1(C2=CC=CC=C2)=COC2C(=CC=C(OCC(OCC3C=CC=CC=3)=O)C=2)C1=O
MolPort-007-921-281 0.60 CSc1ccccc1NC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccncc2)c1
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MolPort-003-057-721 0.60 COCCNC(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)c2ccc(OC)cc2)c1
MCULE-8384129957 0.60 C1(C2=CC=C3C(OCCCO3)=C2)=COC2C(=CC(=C(OC(=O)C3C=C(OC)C(=C(OC)C=3)OC)C=2)CCC)C1=O
MolPort-001-744-108 0.60 Clc1ccc(\C=C\c2ccc(=O)n3C[C@H]4C[C@H](CN(C4)C(=O)c4ccncc4)c23)cc1
MCULE-8284784945 0.60 C1(C2=CC=C3C(OCCCO3)=C2)=COC2C(=CC(=C(OC(=O)N(C)C)C=2)CCC)C1=O
MolPort-000-777-414 0.60 CCc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2ccc(OC)c(OC)c2)C1=O
MCULE-2300247929 0.60 C1(=O)C(C2=CC=C(C(OC)=C2)OC)=COC2=CC(O)=CC(O)=C12
MolPort-044-431-382 0.60 [O-][N+](=O)c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)Cc3c[nH]c4ccccc34)Cn2c1=O
MCULE-6383387852 0.60 C1(C2=CC=CC=C2)=C(C)OC2C(=CC=C(OCC(OCC)=O)C=2)C1=O
MolPort-007-920-831 0.60 [O-][N+](=O)c1cc(ccc1N1CC2CC(C1)c1cccc(=O)n1C2)C(=O)NCCC1=CCCCC1
MCULE-6414382567 0.60 C1(C[C@@H](O)C(O)(C)C)C=C2C=CC(=O)OC2=CC=1OC
MolPort-046-107-182 0.60 Cc1cc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cn2ccnc12
MCULE-8428832122 0.60 O=C1C2C=CC(=C([C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C=2OC=C1C1C=CC(OC)=CC=1)O
MolPort-001-744-340 0.60 COc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccccc1
MCULE-5887901854 0.60 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC(=C(OC(=O)C3C=C(OC)C(=C(OC)C=3)OC)C=2)CC)C1=O
MolPort-002-516-354 0.60 [O-][N+](=O)c1ccc(cc1)C(=O)NC(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(Cl)(Cl)Cl
MCULE-4753720010 0.60 C1(C2C=CC(=CC=2)Br)=C(C)OC2C(=CC=C(C=2)OC(C)C(O)=O)C1=O
MolPort-002-515-988 0.60 Cc1oc(cc1C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)C(C)(C)C
MCULE-2694509377 0.60 C1(O)C=C2OC=C(C3C(O)=CC(O)=CC=3)C(=O)C2=C(O)C=1C/C=C(\C)/C
MolPort-001-745-165 0.60 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1c(NC(=O)Nc3cccc(c3)C#N)ccc(=O)n1C2
MCULE-2615476821 0.60 C1(O)C=C2OC=C(C3C=C(OC)C(O)=CC=3)C(=O)C2=C(O)C=1
MolPort-044-544-778 0.60 COc1ccc(CCC(=O)N2C[C@@H]3C[C@H](C2)c2ccc([N+]([O-])=O)c(=O)n2C3)cc1OC
MCULE-6034907972 0.60 C1(=O)OC2=CC(=CC=C2C=C1C1C=CC(=CC=1)OC)OC(C)C(OCC)=O
MolPort-044-563-999 0.60 O=C(NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cc(n[nH]1)-c1ccccc1
MCULE-8131402232 0.60 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(OC)C=2)C1=O
MolPort-002-513-561 0.60 CN1C(=O)N(C)C(=O)C(CN2CC3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(Br)s2)C1=O
MCULE-3286360559 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3OC)OC)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-001-745-009 0.60 Fc1cccc(c1)S(=O)(=O)Nc1ccc2[C@@H]3C[C@@H](CN(CCCc4ccccc4)C3)Cn2c1=O
MCULE-9303590418 0.60 C1(C(F)(F)F)OC2C=C(OCC(OC)=O)C(=CC=2C(=O)C=1C1C=CC2=C(OCCO2)C=1)CCC
MolPort-008-347-812 0.60 OC(=O)Cn1cc(C(N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(O)=O)c2ccccc12
MCULE-9269101839 0.60 C1(C2=CC=C(C=C2)Cl)=COC2C(=CC=C(OCCBr)C=2)C1=O
MolPort-005-946-301 0.60 COc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)COc3ccccc3)c12
MCULE-5373874989 0.60 C1(=O)C(C2=CC=C(C=C2)O[C@@H]2O[C@H](CO)[C@H]([C@H](O)[C@H]2O)O)=COC2=CC(OC)=CC(O)=C12
MolPort-001-743-550 0.60 COc1ccccc1NC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(C3CCCCC3)c(=O)n1C2
MCULE-7035382550 0.60 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=C(OC)C=3)OCC(C)C)C=21)=O)C1=CC=C(C=C1)O
MolPort-001-743-759 0.60 OCc1ccc(CN2C[C@@H]3C[C@H](C2)c2ccc(C4CCCCC4)c(=O)n2C3)o1
MCULE-6034249099 0.60 C1(C2C=CC3=C(OCO3)C=2)=C(C)OC2=C(C=C(C(OCC(OC)=O)=C2)CC)C1=O
MolPort-019-558-411 0.60 COC(=O)c1ccc(NC(=O)CSC(=S)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MCULE-9785088399 0.60 C1(=O)C(C2C=CC(=CC=2)OC)=COC2C=C(O[C@@H]3O[C@H](CO)[C@H]([C@H](O)[C@H]3O)O)C=C(O)C1=2
MolPort-000-770-243 0.60 COc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(OC)c(OC)c2)C1=O
MCULE-4073115303 0.60 C1(C2=CC=C3C(OCCCCO3)=C2)=C(C)OC2=C(C=C(C(O)=C2)CC)C1=O
MolPort-001-743-201 0.60 CN(C)CC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)S(C)(=O)=O)Cn2c1=O
MCULE-1184605461 0.60 C1(C2=CC=C3C(OCCCO3)=C2)=COC2=C(C=CC(O)=C2C)C1=O
MolPort-002-517-653 0.60 CSCC[C@H](NC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)C(=O)Nc1ccc(C)c(C)c1
MCULE-5266406771 0.60 C1(C2C=CC=CN=2)=COC2=C(C=C(C(OC)=C2)CCCC)C1=O
MolPort-046-768-585 0.60 Cl.FC(F)(F)c1ccc2Sc3ccccc3N(C(=O)CN3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1
MCULE-5003047549 0.60 C1(C2C=CC3=C(OCCCO3)C=2)=COC2=C(C=CC(O)=C2)C1=O
MolPort-001-744-507 0.60 O=C(Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3cccnc3)Cn2c1=O)c1ccncc1
MCULE-5621839500 0.60 C1(C2C=CC3=C(OCCCCO3)C=2)=C(C)OC2=C(C=C(C(OC(C)=O)=C2)CC)C1=O
MolPort-001-744-435 0.60 Fc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)c3ccncc3)c(=O)n1C2
MCULE-2416938276 0.60 C1(C2C=CC3=C(OCO3)C=2)=C(CC)OC2=C(C=C(C(OC(CC)=O)=C2)CCC)C1=O
MolPort-001-744-974 0.60 CN(C)CC(=O)Nc1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccc(cc3)-c3ccccc3)Cn2c1=O
MCULE-6383852688 0.60 C1(C2C=CC3=C(OCCO3)C=2)=C(CC)OC2=C(C=CC(OC(CC)=O)=C2)C1=O
MolPort-035-670-031 0.60 O=C(Nc1ccccc1)C(SC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)c1ccccc1
MCULE-9292265863 0.60 C1(C2C=CC3=C(OCCCO3)C=2)=C(CCC)OC2=C(C=C(C(OCC(OC)=O)=C2)CC)C1=O
MolPort-019-558-472 0.60 CC1Cc2ccccc2N1C(=O)CSC(=S)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-9466207475 0.60 C1(C2C=CC3=C(OCO3)C=2)=C(C)OC2=C(C=C(C(OC)=C2)CCC)C1=O
MolPort-002-567-853 0.60 Fc1c(F)c(F)c(Oc2cccc(NC(=O)N3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2)c(F)c1F
MCULE-3662538887 0.60 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC=C(OC[C@H]3[C@H](O)[C@@H](O)[C@@H]([C@@H](CO)O3)O)C=2)C1=O
MolPort-027-563-941 0.60 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCN(CC1)c1ccc(F)cc1
MCULE-5730136609 0.60 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=C(OCC(OC)=O)C=3)OC)C=21)=O)C1=CC=C(C=C1)O
MolPort-001-744-094 0.60 C\C=C\c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)Nc3ccc(C)cc3)c12
MCULE-8235540060 0.60 C1(C2C=CC3=C(OCCO3)C=2)=C(CCC)OC2=C(C=C(C(O)=C2)CC)C1=O
MolPort-003-023-776 0.60 O=C(CCc1ccccc1)Nc1ccc(cc1)S(=O)(=O)N1CC2CC(C1)c1cccc(=O)n1C2
MCULE-7961152922 0.60 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=C(F)C(=C(F)C=3)F)C=21)=O)C1=CC=C(C=C1)O
MolPort-000-790-702 0.60 CCn1c2ccccc2c2cc(NC(=O)[C@H](CCSC)NC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)ccc12
MCULE-8903419310 0.60 C1(C2C=CC3=C(OCCO3)C=2)=C(CC)OC2=C(C=C(C(O)=C2)CC)C1=O
MolPort-007-930-875 0.60 COc1cccc(NC(=O)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(O)=O)c1
MCULE-8907771873 0.60 C12OC=C(C(=O)C1=CC=C1OC(CC(C3=CC=C(C=C3)C(OC)=O)C=21)=O)C1=CC=C(C=C1)O
MolPort-035-873-576 0.60 COCCn1c(C)cc(C)c(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1=O
MCULE-5063636044 0.60 C1(=COC2=C(C=C(C(O)=C2)CCCC)C1=O)C1=CC2=C(C=CC=C2)O1
MolPort-035-873-462 0.60 COc1ccc2cnn(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c(=O)c2c1OC
MCULE-4197508795 0.60 C12OC=C(C(=O)C1=CC=C1OC(CC(C3=CC=CC(OC)=C3OCC(OC)=O)C=21)=O)C1=CC=C(C=C1)O
MolPort-042-603-672 0.60 N#CC1(CCCNC1)c1ccccn1
MCULE-7618292008 0.60 C1(=COC2=C(C=C(C(OC=O)=C2)CCC)C1=O)C1=CC2=C(C=CC=C2)O1
MolPort-001-743-129 0.60 COc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)C3CCCCC3)c(=O)n1C2
MCULE-8500910584 0.60 C1(C2C=CC=CC=2)=COC2C(=CC=C(OCC3C=CC=C(Br)C=3)C=2)C1=O
MolPort-001-743-744 0.60 O=c1c(ccc2[C@@H]3C[C@@H](CN(Cc4cccs4)C3)Cn12)-c1cncnc1
MCULE-8751708569 0.60 C12OC=C(C(=O)C1=CC=C(O)C=2C(CC(OC)=O)C1C=CC=C(O)C=1)C1=CC=C(C=C1)O
MolPort-046-424-667 0.60 O=C(COc1ccc2nc3CCCn3c(=O)c2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-6360578878 0.60 C1(C=O)=COC2C(=CC=C(OCCC3C=CC=CC=3)C=2)C1=O
MolPort-006-810-380 0.60 Oc1nc(SCC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)nc(O)c1Cc1ccccc1
MCULE-9737978067 0.60 C1(=O)C2=CC3OCCOC=3C=C2OC(CCCC(O)=O)=C1C1=CC=C(C=C1)OC
MolPort-007-900-708 0.60 CCOc1ccc(\C=N\NC(=O)c2ccc(O)cc2)cc1CN1CC2CC(C1)c1cccc(=O)n1C2
MCULE-7027145286 0.60 C1(C2C=CC(=CC=2)OC)=COC2C(=CC=C(OCCN3CCCCC3)C=2)C1=O
MolPort-007-901-259 0.60 CCOc1ccc(\C=N\NC(=O)c2ccc(N)cc2)cc1CN1CC2CC(C1)c1cccc(=O)n1C2
MCULE-8328027811 0.60 C1(C2C=CC3=C(OCCO3)C=2)=COC2=C(C=CC(=C2)OC([C@@]([H])(C)[NH3+])=O)C1=O.[Br-]
MolPort-001-743-488 0.60 OC(=O)CSCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3cccnc3)c(=O)n1C2
MCULE-2800832890 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(F)C=3F)F)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-029-999-169 0.60 CC(C)Cc1ccc(cc1)-c1cc(n[nH]1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-7870948054 0.60 C12OC=C(C(=O)C1=CC=C(O)C=2C(CC(OC)=O)C1C=CC(=C(OC)C=1)OC)C1=CC=C(C=C1)O
MolPort-007-901-315 0.60 CCOc1ccc(\C=N\NC(=O)c2ccc(OC)cc2)cc1CN1CC2CC(C1)c1cccc(=O)n1C2
MCULE-4990174680 0.60 C12OC=C(C(=O)C1=CC=C(OC)C=2C(CC(OC)=O)C1C=CC(=C(OC)C=1)OC)C1=CC=C(C=C1)OC
MolPort-039-194-185 0.60 OCc1cc(=O)c(O)c(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)o1
MCULE-1427432341 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC4=C(OCO4)C=3)C=1OC=C(C1C=CC(=CC=1)O)C2=O
MolPort-042-645-051 0.60 COc1ccc2n(CC(=O)N3C[C@H]4CC(C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc2c1
MCULE-6932887304 0.60 C1(=COC2=C(C=C(C=C2)OC)C1=O)C(CC(OC)=O)C1C(OC)=CC=C2C(C(C3=CC=C(C=C3)OC)=COC=12)=O
MolPort-044-179-430 0.60 COc1ccc2n(CC(=O)N3C[C@@H]4CC(C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc2c1
MCULE-6376003375 0.60 C1(=COC2=C(C=C(C=C2)OC)C1=O)C(CC(OC)=O)C1C(O)=CC=C2C(C(C3=CC=C(C=C3)O)=COC=12)=O
MolPort-001-744-947 0.60 Fc1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2ccc(NC(=O)C4CCCCC4)c(=O)n2C3)cc1
MCULE-1566575283 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)OC(F)F)C=1OC=C(C1C=CC(=CC=1)O)C2=O
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MCULE-6041606508 0.60 C1(=CC(=C2C(=C1)OC=C(C2=O)C1C=CC(O)=CC=1)OC)O[C@H]1[C@H](O)[C@@H](O)[C@H](O)[C@@H](CO)O1
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MCULE-6019717773 0.60 C1(=C(C(=C2C(OC=C(C2=O)C2C=CC(O)=CC=2)=C1C/C=C(\C)/C)O)C/C=C(/C)\C)O
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MCULE-3117712457 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3=CC=C4C(C=CC=N4)=C3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-046-423-678 0.60 COc1ccc(CC(=O)N2C[C@H]3C[C@@H](C2)c2ccc([N+]([O-])=O)c(=O)n2C3)cc1OC
MCULE-7178643942 0.60 C12C(OC)=CC3=C(C(CC(=O)O3)C3C=CC4=C(OCO4)C=3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-035-699-990 0.60 CC(=C)Cn1nc(C)c(CCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c1C
MCULE-9504013462 0.60 C1(C=C2OC=C(C(C2=C(C=1)O)=O)C1C=CC(=CC=1)OC)OC1OC(COC2OC(C)C(O)C(O)C2O)C(O)C(O)C1O
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MCULE-9657983771 0.60 C1(C2C=CC(=CC=2)OC)=COC2C(=CC=C(OCCN3CCC(CC3)C)C=2)C1=O
MolPort-001-743-423 0.60 FC(F)(F)Oc1ccc(cc1)-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)c3ccccc3)Cn2c1=O
MCULE-2520733974 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(F)C=3F)F)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-035-762-433 0.60 CC(=O)c1c(C)nn(CC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1C
MCULE-1543539378 0.60 C12C(O)=CC3=C(C(C4=CC=NC=C4)CC(=O)O3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-046-424-013 0.60 Cn1c2ccccc2c(cc1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MCULE-7991507158 0.60 [C@H]1(CO[C@@H]2OC[C@](O)(CO)[C@H]2O)O[C@@H](OC2C=C3OC=C(C4C=CC(O)=CC=4)C(=O)C3=C(O)C=2)[C@H](O)[C@@H](O)[C@@H]1O
MolPort-035-701-700 0.60 COc1ccc2[nH]cc(CCNC(=O)[C@@H](NC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(C)C)c2c1
MCULE-2719328920 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3=CC=C(C(OC)=C3)OCC(C)=C)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-000-148-226 0.60 CCc1ccc(CC2CCCCN2)nc1
MCULE-7491264970 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC4=C(OCO4)C=3)C=1OC=C(C1C=CC(=CC=1)OC)C2=O
MolPort-001-743-437 0.60 CC(C)NC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(OC(F)(F)F)cc3)c(=O)n1C2
MCULE-7064090251 0.60 C1(C=C2OC=C(C(C2=CC=1OC)=O)C1C=CC(OC)=CC=1)O
MolPort-002-516-590 0.60 COc1ccc(\C=C\C(=O)NC(=S)N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1OC
MCULE-5631773583 0.60 C1(C=C2OC=C(C(C2=CC=1OC)=O)C1C=CC=CC=1)OC
MolPort-035-699-818 0.60 CC(=C)Cc1c(C)nn(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1C
MCULE-6107970634 0.60 C1(O)C=C2C(C(=O)C(=CO2)C2C=CC(OC(C)=O)=CC=2)=CC=1OC
MolPort-017-264-447 0.60 COC(=O)c1cc(NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)ccc1Cl
MCULE-5786116593 0.60 C1(O)C(O)C(O)C(OC1CO)OC1=CC(O)=C2C(=O)C(C3=CC=C(OC)C=C3)=COC2=C1
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MCULE-8922782143 0.60 C1(C2C(C3=C(O)C=CC=C3OC=2)=O)C=CC(O)=CC=1
MolPort-007-932-539 0.60 Cc1ccc(NC(=S)Nc2cc(ccc2N2CC3CC(C2)c2cccc(=O)n2C3)C(=O)NC2CCCc3ccccc23)cc1C
MCULE-1709446045 0.60 C1(C(F)(F)F)OC2C=C(OC(C)C)C(=CC=2C(=O)C=1C1=CC=C2C(OCCO2)=C1)C(C)C
MolPort-002-516-732 0.60 Cn1c(SCC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)nc(O)cc1=O
MCULE-6804627803 0.60 C1(C(F)(F)F)OC2C=C(OC(C)C)C(=CC=2C(=O)C=1C1=CC=C2C(OCCO2)=C1)CC
MolPort-001-744-919 0.60 CC(=O)N1CCC(CC1)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccccc3CN3CCOCC3)c(=O)n1C2
MCULE-6385948748 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3C=C(OC)C4=C(OCCO4)C=3)C=1OC=C(C1=CC=C(C=C1)Cl)C2=O
MolPort-039-194-080 0.60 O=C(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)\C=C\c1ccco1
MCULE-5495005094 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3C=C(OC)C(=CC=3OC)OC)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-044-179-908 0.60 COc1cccc2n(CCC(=O)N3C[C@@H]4CC(C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc12
MCULE-3676528871 0.60 C12OC=C(C(=O)C1=CC=C1OC(CC(C3=CC=C(C=C3)C(O)=O)C=21)=O)C1C=CC=CC=1
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MCULE-6058427641 0.60 C1(C2C=CC=CC=2Cl)=COC2=C(C=CC(OC(C)=O)=C2C)C1=O
MolPort-001-744-045 0.60 O=C(Nc1ccccc1)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1cccnc1
MCULE-4979453753 0.60 C1(C2C=CC=CC=2OC)C(=O)C2=CC=C(C=C2OC=1C(F)(F)F)OCCC1C=CC=CC=1
MolPort-001-744-758 0.60 Fc1ccc(CN2C[C@@H]3C[C@H](C2)c2ccc(-c4ccccc4CN4CCOCC4)c(=O)n2C3)cc1
MCULE-2485647758 0.60 C12OC=C(C(=O)C1=CC=C(OC)C=2C(CC(OC)=O)C1C=C(OC)C(=CC=1OC)OC)C1=CC=C(C=C1)OC
MolPort-008-323-899 0.60 Fc1ccc(OP(=O)(Oc2ccc(F)cc2)N2CC3CC(C2)c2cccc(=O)n2C3)cc1
MCULE-2656241301 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3=COC4=C(C=C(C=C4)C)C3=O)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-002-167-537 0.60 [O-][N+](=O)c1ccc(cc1)-c1ccc(CN2CC3CC(C2)c2cccc(=O)n2C3)o1
MCULE-7700160037 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC=CC=3OCC(C)=C)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-001-743-809 0.60 COc1ccc(cc1)-c1ccc(=O)n2C[C@H]3C[C@H](CN(C3)C(=O)c3ccncc3)c12
MCULE-3653108673 0.60 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(OCC(=O)OC3CCCCC3)C=2)C1=O
MolPort-001-743-801 0.60 COc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc(OC)cc1
MCULE-2819940459 0.60 C12OC=C(C(=O)C=1C=CC1OC(CC(C3=CC=C(C=C3)C(C)C)C2=1)=O)C1=CC=C(C(OC)=C1)OC
MolPort-001-743-256 0.60 OC(=O)CSCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc4ccccc4c3)c(=O)n1C2
MCULE-8709163336 0.60 C1(C2=CC=CC=C2Cl)=COC2C(=CC=C(OCC)C=2)C1=O
MolPort-044-566-639 0.60 COc1cccc2n(CCC(=O)N3C[C@H]4C[C@@H](C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc12
MCULE-7269942980 0.60 C1(C2C=CC(=CC=2)Cl)=COC2C(=CC=C(OCC(OCCOCC)=O)C=2)C1=O
MolPort-044-180-173 0.60 CC(C)n1ccc2c(cccc12)C(=O)N1C[C@@H]2CC(C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MCULE-7447686236 0.60 C1(C2=CC=CC=C2OC)=COC2C(=CC=C(C=2)OC(C)C(=O)OC2CCCCC2)C1=O
MolPort-001-743-301 0.60 Fc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc(Cl)cc3)c(=O)n1C2
MCULE-3231381648 0.60 C1(C(F)(F)F)OC2C=C(C(=CC=2C(=O)C=1C1C=CC2=C(OCCO2)C=1)CCC)OC(C)C(OC)=O
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MCULE-4828384517 0.60 C12OC=C(C(=O)C=1C=CC1OC(CC(C3=CC(OC)=C(C(OC)=C3)OC)C2=1)=O)C1=CC=C(C(OC)=C1)OC
MolPort-001-743-265 0.60 CCCS(=O)(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccc4ccccc4c3)c(=O)n1C2
MCULE-6779979807 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3=CC=CC(OC)=C3OCC(OC)=O)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-020-186-315 0.60 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cnn2CCCCc12
MCULE-8693554941 0.60 C12C(O)=CC3=C(C(C4=CC=C(C=C4)C#N)CC(=O)O3)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-007-922-771 0.60 CCC1CCCCN1C(=O)c1ccc(N2CC3CC(C2)c2cccc(=O)n2C3)c(NC(=O)\C=C\c2ccccc2)c1
MCULE-1994802776 0.60 C1(C2=CC=C(C=C2)Br)=COC2C(=CC=C(OCC3=CC=C(C=C3)Br)C=2)C1=O
MolPort-044-566-385 0.60 CC(C)n1ccc2c(cccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MCULE-2484416983 0.60 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(OCC3=CC=C(C=C3)Br)C=2)C1=O
MolPort-027-846-724 0.60 Oc1nc(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)nc2ccsc12
MCULE-4440896663 0.60 C1(C2=CC=C(C=C2)OC)=COC2C(=CC=C(OCC3C=CC(=CC=3)C=C)C=2)C1=O
MolPort-003-799-881 0.60 Fc1ccc(OP(=O)(Oc2ccc(F)cc2)N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1
MCULE-8239511422 0.60 C1(C2=CC=C(C=C2)O)=COC2=C(C=CC(O)=C2)C1=O
MolPort-044-543-731 0.60 Oc1c(cnc2c(OC(F)(F)F)cccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-5398324711 0.60 C1(C2=CC=CC=C2)=COC2C(=CC=C(OCC3C=C(C)C=CC=3C)C=2)C1=O
MolPort-001-743-827 0.60 COc1ccc(cc1)C(=O)N1C[C@@H]2C[C@H](C1)c1c(ccc(=O)n1C2)-c1ccc2ccccc2c1
MCULE-1664996392 0.60 C12OC=C(C(=O)C=1C=CC1OC(CC(C3C=CC(=C(OC)C=3OC)OC)C2=1)=O)C1=CC=C(C(OC)=C1)OC
MolPort-044-565-599 0.60 Cn1c(SCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)nc(O)cc1=O
MCULE-3426525275 0.60 C1(=O)OC2=CC(=CC=C2C=C1C1=CC=CC=C1)OCC(OC(C)C)=O
MolPort-002-511-721 0.60 O=C1NC(=O)C(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)(Cc2cccs2)C(=O)N1Cc1ccccc1
MCULE-4774737677 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3=COC4=C(C=CC=C4)C3=O)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-019-825-770 0.60 OCc1cc(=O)c(O)c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)o1
MCULE-7068775715 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OCC(OC)=O)C=3)OC)C=1OC=C(C1=CC=C(C(OC)=C1)OC)C2=O
MolPort-002-514-074 0.60 Fc1ccc(OP(=O)(Oc2ccc(F)cc2)N2CC3C[C@H](C2)c2cccc(=O)n2C3)cc1
MCULE-9035593685 0.60 C1(=O)OC2=CC(=CC=C2C=C1C1=CC=CC=C1)OCC(=O)OC(C)(C)C
MolPort-001-744-949 0.60 CC(=O)c1ccc(NC(=O)N2C[C@@H]3C[C@H](C2)c2ccc(NC(=O)C4CCCCC4)c(=O)n2C3)cc1
MCULE-1988731175 0.60 C1(=O)OC2=CC(=CC=C2C=C1C1=CC=C(C=C1)OC)OC(=O)C1CC1
MolPort-029-885-663 0.60 CC(C)Cc1ccc(cc1)-c1cc([nH]n1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-1649719389 0.60 C1(C(F)(F)F)OC2C=C(OC)C(=CC=2C(=O)C=1C1=CC=CC=C1)CC
MolPort-001-743-509 0.60 CSCC(=O)N1C[C@@H]2C[C@H](C1)c1ccc(-c3ccccc3CN(C)C)c(=O)n1C2
MCULE-9337368368 0.60 C1(=O)C2C=CC(=C(C)C=2OC(C)=C1C1=CC=CC=C1)OC
MolPort-001-743-140 0.60 O=C(COc1ccccc1)N1C[C@@H]2C[C@H](C1)c1ccc(NC(=O)C3CCCCC3)c(=O)n1C2
MCULE-5542335327 0.60 C1(C2=CC=CC=C2Cl)=COC2C(=CC=C(C=2)OC(=O)C(C)(C)C)C1=O
MolPort-046-597-854 0.60 COc1ccc2n(CC(=O)N3C[C@@H]4C[C@@H](C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc2c1
MCULE-4520854531 0.60 C1(=COC2=C(C=C(C=C2)OC)C1=O)C1CC(=O)OC2=CC=C3C(C(C4C=CC=CC=4)=COC3=C12)=O
MolPort-046-597-841 0.60 COc1cccc2n(CCC(=O)N3C[C@@H]4C[C@H](C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc12
MCULE-8676191521 0.60 C1(C(F)(F)F)OC2C=C(O)C(=CC=2C(=O)C=1C1C=CC2=C(OCCO2)C=1)CCC
MolPort-046-597-711 0.60 CC(=C)Cn1nc(C)c(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1C
MCULE-8112478505 0.60 C1(C2=CC=C3C(OCCO3)=C2)=C(CC)OC2=C(C=CC(OC(C)C)=C2)C1=O
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MCULE-4451798718 0.60 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=C(OC)C=3)OC)C=21)=O)C1C=CC=CC=1
MolPort-046-596-987 0.60 O=C(COc1ccc2nc3CCCn3c(=O)c2c1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-7767496689 0.60 CCCC1=C(OC(C)=O)C=C2C(C(C(C3=CC4=C(OCO4)C=C3)=C(O2)C)=O)=C1
MolPort-046-423-628 0.60 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)Cc3c[nH]c4ccccc34)Cn2c1=O
MCULE-7193511250 0.60 C1(=O)OC2=CC(=CC=C2C=C1C1=CC=C(C=C1)F)OCC(=O)C1C=CC(=CC=1)Br
MolPort-044-179-430 0.60 COc1ccc2n(CC(=O)N3C[C@@H]4CC(C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc2c1
MCULE-9564212842 0.60 C1(=O)OC2=CC(=CC=C2C=C1C1C=CC(=CC=1)OC)OC(C1=CC=CC=C1)C(OCC)=O
MolPort-001-743-393 0.60 Cc1ccccc1-c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)Nc3ccccc3)Cn2c1=O
MCULE-5369075302 0.60 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=CC(=C(Cl)C=3)O)C=21)=O)C1C=CC=CC=1
MolPort-046-424-499 0.60 COc1ccc(CCC(=O)N2C[C@H]3C[C@@H](C2)c2ccc([N+]([O-])=O)c(=O)n2C3)cc1OC
MCULE-7754069356 0.60 C12OC=C(C(=O)C1=CC=C1OC(CC(C3C=C(OC)C(=CC=3OC)OC)C=21)=O)C1C=CC=CC=1
MolPort-035-670-031 0.60 O=C(Nc1ccccc1)C(SC(=S)N1CC2CC(C1)c1cccc(=O)n1C2)c1ccccc1
MCULE-3155640866 0.60 C1(=O)OC2=CC(=CC=C2C=C1C1C=CC=CC=1)OCC(O)=O
MolPort-044-544-301 0.60 [O-][N+](=O)c1ccc2[C@@H]3C[C@H](CN(C3)C(=O)Cc3c[nH]c4ccccc34)Cn2c1=O
MCULE-5648990482 0.60 C1(C2C=CC(=CC=2)F)=C(C)OC2C(=CC=C(OCC(=O)C3=CC=C(C=C3)OC(F)F)C=2)C1=O
MolPort-027-718-104 0.60 COC(=O)c1cc(NC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)ccc1F
MCULE-3388982386 0.60 C1(C2C=CC=CC=2OC)=COC2C(=CC=C(OC/C=C(\C)/C)C=2)C1=O
MolPort-046-768-545 0.60 Cl.COC(=O)c1ccc(CN2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)o1
MCULE-2999011221 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3C=C(OC)C(=C(OC)C=3)O)C=1OC=C(C1=CC=C(C=C1)Cl)C2=O
MolPort-044-565-534 0.60 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)Cn3ccc4ccc(Cl)cc34)Cn2c1=O
MCULE-5554330513 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3C=CC(=C(OC)C=3)OC)C=1OC=C(C1=CC=C(C=C1)Cl)C2=O
MolPort-044-810-694 0.60 COc1ccc(CC(=O)N2C[C@H]3C[C@H](C2)c2ccc([N+]([O-])=O)c(=O)n2C3)cc1OC
MCULE-3053176513 0.60 C1(C2C=CC=CC=2Cl)=C(C)OC2C(=CC=C(OCCC)C=2C)C1=O
MolPort-035-873-682 0.60 COCCn1c(cc2cc(Cl)ccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-2952133303 0.60 C1(C2C=CC(=CC=2)C2=CC=CC=C2)=C(C)OC2C(=CC=C(OCC(OC)=O)C=2)C1=O
MolPort-039-194-158 0.60 Clc1ccc2oc(cc2c1)C(=O)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2
MCULE-7432633342 0.60 C1(C2=CC=C3C(OCCO3)=C2)=COC2C(=CC=C(C=2)OC(C2CCCCC2)=O)C1=O
MolPort-046-424-575 0.60 OC(=O)Cn1cc(C(N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)C(O)=O)c2ccccc12
MCULE-4072636553 0.60 C1(C2C=CC3=C(OCCO3)C=2)=C(C)OC2=C(C=CC(OCC)=C2C)C1=O
MolPort-039-194-176 0.60 OC(=O)Cn1cc(C(N2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)C(O)=O)c2ccccc12
MCULE-8430856853 0.60 C1(=O)C2C=C(CC)C(=CC=2OC(C)=C1C1=CC=CC=C1)O
MolPort-046-107-182 0.60 Cc1cc(NC(=O)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cn2ccnc12
MCULE-4627788076 0.60 C1(C2=CC=CC=C2C)=C(C)OC2=C(C=CC(OC(C)=O)=C2C)C1=O
MolPort-044-543-596 0.60 CSCC[C@@H](C(=O)N1C[C@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2)n1cccc1
MCULE-6798812646 0.60 C1(C(F)(F)F)OC2C=C(OCC)C(=CC=2C(=O)C=1C1=CC=C(C=C1)F)CC
MolPort-035-873-807 0.60 COc1ccc(cc1)-c1n[nH]c(C)c1CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MCULE-4849860565 0.60 C12C(O)=CC3=C(C(CC(=O)O3)C3C=C(OC)C(=C(OC)C=3)OC)C=1OC=C(C1=CC=C(C=C1)Cl)C2=O
MolPort-044-179-909 0.60 CCCCc1cc(=O)oc2c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c(O)ccc12
MCULE-9957754115 0.60 C12OC=C(C(=O)C=1C=CC1OC(CC(C3C=CC=C(O)C=3)C2=1)=O)C1C=CC(=CC=1)F
MolPort-044-544-276 0.60 [O-][N+](=O)c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)COc3ccccc3)Cn2c1=O
MCULE-1484181436 0.60 C1(C(F)(F)F)OC2C=C(OCC(O)=O)C(=CC=2C(=O)C=1C1C=CC(=CC=1)F)CC
MolPort-046-768-585 0.60 Cl.FC(F)(F)c1ccc2Sc3ccccc3N(C(=O)CN3C[C@@H]4C[C@@H](C3)c3cccc(=O)n3C4)c2c1
MCULE-7749927373 0.60 C12OC=C(C(=O)C=1C=CC1OC(CC(C3C=C(OC)C(=C(OC)C=3)O)C2=1)=O)C1C=CC(=CC=1)F
MolPort-039-194-031 0.60 CCOc1cc(CC2(CN3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)C(=O)N(C)C(=S)N(C)C2=O)cc(Br)c1O
MCULE-4695685623 0.60 C1(C2=CC=C3C(OCCCO3)=C2)=C(C)OC2C(=CC(=C(OCC#N)C=2)CC)C1=O
MolPort-044-544-778 0.60 COc1ccc(CCC(=O)N2C[C@@H]3C[C@H](C2)c2ccc([N+]([O-])=O)c(=O)n2C3)cc1OC
MolPort-038-432-231 0.60 COc1ccc(cc1)-c1[nH]nc(C)c1CC(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-027-718-213 0.60 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCN(Cc2ccccc2Cl)CC1
MolPort-039-193-993 0.60 CN1C(=O)N(C)C(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(Br)s2)C1=O
MolPort-046-423-678 0.60 COc1ccc(CC(=O)N2C[C@H]3C[C@@H](C2)c2ccc([N+]([O-])=O)c(=O)n2C3)cc1OC
MolPort-046-423-628 0.60 [O-][N+](=O)c1ccc2[C@H]3C[C@H](CN(C3)C(=O)Cc3c[nH]c4ccccc34)Cn2c1=O
MolPort-020-217-711 0.60 C\C=C\Cc1nnc(o1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-044-180-389 0.60 [O-][N+](=O)c1ccc2C3C[C@@H](CN(C3)C(=O)Cn3ccc4ccc(Cl)cc34)Cn2c1=O
MolPort-044-180-372 0.60 CCCc1cc(=O)oc2c(CN3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c(O)ccc12
MolPort-044-563-999 0.60 O=C(NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cc(n[nH]1)-c1ccccc1
MolPort-046-595-488 0.60 [O-][N+](=O)c1ccc2C3CC(CN(C3)C(=O)Cc3c[nH]c4ccccc34)Cn2c1=O
MolPort-030-042-381 0.60 COC(=O)c1cc(NC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)ccc1F
MolPort-044-431-382 0.60 [O-][N+](=O)c1ccc2[C@@H]3C[C@@H](CN(C3)C(=O)Cc3c[nH]c4ccccc34)Cn2c1=O
MolPort-039-193-863 0.60 Fc1c(F)c(F)c(Oc2cccc(NC(=O)N3C[C@@H]4C[C@H](C3)c3cccc(=O)n3C4)c2)c(F)c1F
MolPort-039-193-957 0.60 COc1ccc(cc1)N1C(=O)NC(=O)C(CN2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)(Cc2ccc(OC)c(OC)c2)C1=O
MolPort-046-595-483 0.60 [O-][N+](=O)c1ccc2C3CC(CN(C3)C(=O)COc3ccccc3)Cn2c1=O
MolPort-042-645-051 0.60 COc1ccc2n(CC(=O)N3C[C@H]4CC(C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc2c1
MolPort-029-886-580 0.60 COc1ccc(CN2C(=O)N[C@@H](CCC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C2=O)cc1OC
MolPort-044-566-385 0.60 CC(C)n1ccc2c(cccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-029-999-169 0.60 CC(C)Cc1ccc(cc1)-c1cc(n[nH]1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-020-186-315 0.60 O=C(N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2)c1cnn2CCCCc12
MolPort-044-180-173 0.60 CC(C)n1ccc2c(cccc12)C(=O)N1C[C@@H]2CC(C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-035-699-818 0.60 CC(=C)Cc1c(C)nn(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1C
MolPort-035-699-990 0.60 CC(=C)Cn1nc(C)c(CCC(=O)N2CC3CC(C2)c2cccc(=O)n2C3)c1C
MolPort-044-179-908 0.60 COc1cccc2n(CCC(=O)N3C[C@@H]4CC(C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc12
MolPort-035-701-700 0.60 COc1ccc2[nH]cc(CCNC(=O)[C@@H](NC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)C(C)C)c2c1
MolPort-035-762-433 0.60 CC(=O)c1c(C)nn(CC(=O)N2C[C@@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1C
MolPort-046-424-667 0.60 O=C(COc1ccc2nc3CCCn3c(=O)c2c1)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-039-194-080 0.60 O=C(NC(=S)N1C[C@@H]2C[C@H](C1)c1cccc(=O)n1C2)\C=C\c1ccco1
MolPort-046-597-854 0.60 COc1ccc2n(CC(=O)N3C[C@@H]4C[C@@H](C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc2c1
MolPort-046-597-841 0.60 COc1cccc2n(CCC(=O)N3C[C@@H]4C[C@H](C3)c3ccc([N+]([O-])=O)c(=O)n3C4)ccc12
MolPort-046-597-711 0.60 CC(=C)Cn1nc(C)c(CCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1C
MolPort-027-563-941 0.60 Cn1c(CN2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)cc(=O)c(O)c1CN1CCN(CC1)c1ccc(F)cc1
MolPort-035-873-462 0.60 COc1ccc2cnn(CC(=O)N3C[C@H]4C[C@@H](C3)c3cccc(=O)n3C4)c(=O)c2c1OC
MolPort-044-544-589 0.60 Cn1c2ccccc2c(cc1=O)C(=O)N1C[C@@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-042-603-672 0.60 N#CC1(CCCNC1)c1ccccn1
MolPort-035-873-576 0.60 COCCn1c(C)cc(C)c(C(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)c1=O
MolPort-044-565-599 0.60 Cn1c(SCC(=O)N2C[C@H]3C[C@@H](C2)c2cccc(=O)n2C3)nc(O)cc1=O
MolPort-039-194-185 0.60 OCc1cc(=O)c(O)c(CN2C[C@H]3C[C@H](C2)c2cccc(=O)n2C3)o1
MolPort-044-564-000 0.60 COc1ccc(cc1)-c1n[nH]c(C)c1CC(=O)NCCN1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-596-987 0.60 O=C(COc1ccc2nc3CCCn3c(=O)c2c1)N1C[C@@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-029-885-663 0.60 CC(C)Cc1ccc(cc1)-c1cc([nH]n1)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2
MolPort-046-424-013 0.60 Cn1c2ccccc2c(cc1=O)C(=O)N1C[C@H]2C[C@@H](C1)c1ccc([N+]([O-])=O)c(=O)n1C2
MolPort-039-194-072 0.60 COc1ccc(\C=C\C(=O)NC(=S)N2C[C@@H]3C[C@H](C2)c2cccc(=O)n2C3)cc1OC
MolPort-044-543-731 0.60 Oc1c(cnc2c(OC(F)(F)F)cccc12)C(=O)N1C[C@H]2C[C@@H](C1)c1cccc(=O)n1C2