Sanitize It Yourself
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Substructure Search
Nearest Neighbor Search
O=C(C[C@@H]1C[NH2+]CCO1)N[C@H]1C=CS(=O)(=O)C1
Ro5
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O=C(Cc1ccc(Cl)cc1)/N=C1/S[C@@H]2CS(=O)(=O)C[C@H]2N1c1cc(Cl)ccc1Cl
Ro5
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COc1ccc(N2/C(=N/C(=O)CCCC(=O)[O-])S[C@@H]3CS(=O)(=O)C[C@H]32)cc1Cl
Ro5
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CC[C@@H](C)NS(=O)(=O)c1cc(N2C(=O)[C@@H](C)CS2(=O)=O)ccc1OC
Ro5
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Nearest Neighbor Search
O=C(COc1ccc(Br)cc1)N[C@H]1CCS(=O)(=O)C1
Ro5
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CCOCCS(=O)(=O)[N-]c1cc(Br)ccc1O
Ro5
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Substructure Search
Nearest Neighbor Search
COc1ccc(F)cc1NC(=O)c1sccc1S(=O)(=O)N(C)C
Ro5
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Substructure Search
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O=C(Nc1ccc(S(=O)(=O)NC[C@@H]2CCCO2)cc1)[C@H]1CC(=O)N(c2ccc(F)c(Cl)c2)C1
Ro5
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Substructure Search
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COc1ccc(S(=O)(=O)N2CCOCC2)cc1NC(=O)/C=C/c1ccc(F)c(Cl)c1
Ro5
MCF
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Substructure Search
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C#CCN(Cc1cc(Br)cc(OC)c1O)[C@@H]1CCS(=O)(=O)C1
Ro5
PAINS
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Substructure Search
Nearest Neighbor Search
COc1ccc(CCCC(=O)Nc2cccc(S(N)(=O)=O)c2)cc1F
Ro5
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Substructure Search
Nearest Neighbor Search
COc1ccc(CNC(=O)c2cc(N3C(=O)C(C)(C)CS3(=O)=O)ccc2Cl)cc1OC
Ro5
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