General Information of the Compound
| Compound ID |
CP0547625
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| Compound Name |
N-benzyl-4-[(3-chlorophenyl)sulfamoyl]-N-(2-cyanoethyl)benzamide
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| Structure |
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| Formula |
C23H20ClN3O3S
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| Molecular Weight |
453.951
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| Canonical SMILES |
Clc1cccc(NS(=O)(=O)c2ccc(cc2)C(=O)N(CCC#N)Cc2ccccc2)c1
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| InChI |
InChI=1S/C23H20ClN3O3S/c24-20-8-4-9-21(16-20)26-31(29,30)22-12-10-19(11-13-22)23(28)27(15-5-14-25)17-18-6-2-1-3-7-18/h1-4,6-13,16,26H,5,15,17H2
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| InChIKey |
SOPCZMCBKNDKLK-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
Protein ID: PT02178, LIM domain kinase 1
Protein ID: PT01347, LIM domain kinase 2