General Information of the Compound
| Compound ID |
CP0858018
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| Compound Name |
4-tert-butyl-N-(4-chloro-2-(2-(methylthio)pyridine-4-carbonyl)phenyl)benzenesulfonamide
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| Structure |
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| Formula |
C23H23ClN2O3S2
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| Molecular Weight |
475.035
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| Canonical SMILES |
CSc1cc(C(=O)c2cc(Cl)ccc2NS(=O)(=O)c2ccc(C(C)(C)C)cc2)ccn1
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| InChI |
InChI=1S/C23H23ClN2O3S2/c1-23(2,3)16-5-8-18(9-6-16)31(28,29)26-20-10-7-17(24)14-19(20)22(27)15-11-12-25-21(13-15)30-4/h5-14,26H,1-4H3
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| InChIKey |
HXHMYYGSMXXGJS-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