Sanitize It Yourself
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Substructure Search
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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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COc1ccc([C@@H](NC(=O)Nc2cc(C)ccc2Cl)C2CCOCC2)cc1
Ro5
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C=CCN(Cc1cccc([N+](=O)[O-])c1)C(=O)Nc1cc(OC)ccc1Cl
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CCC1(CC)[C@@H](NC(=O)Nc2ccc(C(=O)NC)cc2)[C@H](C)[C@@H]1OC
Ro5
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CSc1ccccc1NC(=O)N[C@@H](CO)c1ccc(Cl)cc1
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CC(C)CNC(=O)NC(=O)[C@@H](C)Nc1ccc(OC(C)C)cc1
Ro5
PAINS
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Substructure Search
Nearest Neighbor Search
C=CCO[C@H](C)C(=O)Nc1ccc(F)cc1Br
Ro5
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Substructure Search
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COC(=O)[C@H]1CCC[C@H]1NC(=O)Nc1ccc(C)cc1C
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COc1ccc([C@@H]2NC(=O)N[C@@](O)(C(F)(F)F)[C@H]2C(=O)c2ccc(F)cc2)cc1OC
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CCCC[C@@H](NC(N)=O)C(=O)Nc1cc(OC)ccc1F
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Substructure Search
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C[C@@H](c1ccc(Cl)cc1Cl)N(C)C(=O)c1ccc(NC(N)=O)cc1
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Substructure Search
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C[C@H](CNC(=O)c1ccc(-c2ccccc2)[nH]c1=O)Oc1ccc(F)cc1
Ro5
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