General Information of the Compound
| Compound ID |
CP0866400
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| Compound Name |
5-(5-chloro-2-(4-(3-methoxy-3-oxopropyl)phenylsulfonamido)benzoyl)-2-methylpyridine 1-oxide
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| Structure |
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| Formula |
C23H21ClN2O6S
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| Molecular Weight |
488.949
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| Canonical SMILES |
COC(=O)CCc1ccc(S(=O)(=O)Nc2ccc(Cl)cc2C(=O)c2ccc(C)[n+]([O-])c2)cc1
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| InChI |
InChI=1S/C23H21ClN2O6S/c1-15-3-7-17(14-26(15)29)23(28)20-13-18(24)8-11-21(20)25-33(30,31)19-9-4-16(5-10-19)6-12-22(27)32-2/h3-5,7-11,13-14,25H,6,12H2,1-2H3
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| InChIKey |
JBOCAVWGWXRRSG-UHFFFAOYSA-N
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| Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
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Map of Molecular Bioactivity Related to the Compound
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Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
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Table of Molecular Bioactivities Related to the Compound