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CNC(=O)c1ccc(/C=C/C(=O)Nc2c(C)cc(C)nc2Cl)cc1
Ro5
MCF
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O=C(NCc1nccc2ccccc12)c1ccc[nH]c1=O
Ro5
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COC(=O)[C@](NC(=O)c1cccc(Cl)c1)(Nc1ccc(Br)c[nH+]1)C(F)(F)F
Ro5
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Cc1cc(N(C)C)ccc1NC(=O)c1c[nH]c2nccc(Cl)c12
Ro5
PAINS
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O=C(CCc1nc2ccccc2c(=O)[nH]1)Nc1cc(Cl)c(Cl)cc1Cl
Ro5
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NC(=O)c1ccc(NC(=O)c2cccn(Cc3ccc(F)cc3)c2=O)cc1
Ro5
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COc1ccccc1[C@@H](C)NC(=O)c1cnc2c(C)cccn2c1=O
Ro5
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COc1ccc([C@@H]2NC(=O)N[C@@](O)(C(F)(F)F)[C@H]2C(=O)c2ccc(F)cc2)cc1OC
Ro5
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COc1cccnc1N(C)C(=O)C[C@H](C)Cc1ccc(Cl)cc1
Ro5
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COc1cc(OC)cc(C(=O)Nc2ccccc2C(=O)NC(C)(C)C)c1
Ro5
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Cc1ccc(NC(=O)/C(C#N)=C/c2cc(C)n(-c3ccc(O)cc3)c2C)cc1Cl
PAINS
MCF
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1
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Substructure Search
Nearest Neighbor Search
O=C(COc1ncnc2ccc(Br)cc12)Nc1ccccc1Cl
Ro5
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