General Information of the Compound
| Compound ID |
CP0866401
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| Compound Name |
4-acetyl-N-(4-chloro-2-(6-methylnicotinoyl)phenyl)benzenesulfonamide
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| Structure |
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| Formula |
C21H17ClN2O4S
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| Molecular Weight |
428.897
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| Canonical SMILES |
CC(=O)c1ccc(S(=O)(=O)Nc2ccc(Cl)cc2C(=O)c2ccc(C)nc2)cc1
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| InChI |
InChI=1S/C21H17ClN2O4S/c1-13-3-4-16(12-23-13)21(26)19-11-17(22)7-10-20(19)24-29(27,28)18-8-5-15(6-9-18)14(2)25/h3-12,24H,1-2H3
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| InChIKey |
HKMPLSIYHIFSIE-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