General Information of the Compound
Compound ID |
CP0903309
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Compound Name |
4-(2-(4-tert-butylphenylsulfonamido)-5-chlorobenzoyl)-2-methylpyridine 1-oxide
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Structure |
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Formula |
C23H23ClN2O4S
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Molecular Weight |
458.967
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Canonical SMILES |
Cc1cc(C(=O)c2cc(Cl)ccc2NS(=O)(=O)c2ccc(C(C)(C)C)cc2)cc[n+]1[O-]
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InChI |
InChI=1S/C23H23ClN2O4S/c1-15-13-16(11-12-26(15)28)22(27)20-14-18(24)7-10-21(20)25-31(29,30)19-8-5-17(6-9-19)23(2,3)4/h5-14,25H,1-4H3
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InChIKey |
ZTNLUDSKAPDYEE-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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ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
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