General Information of the Compound
Compound ID |
CP0501039
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Compound Name |
N-[4-[5-amino-1-(4-methylphenyl)pyrazol-3-yl]phenyl]benzenesulfonamide
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Structure |
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Formula |
C22H20N4O2S
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Molecular Weight |
404.495
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Canonical SMILES |
Cc1ccc(cc1)-n1nc(cc1N)-c1ccc(NS(=O)(=O)c2ccccc2)cc1
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InChI |
InChI=1S/C22H20N4O2S/c1-16-7-13-19(14-8-16)26-22(23)15-21(24-26)17-9-11-18(12-10-17)25-29(27,28)20-5-3-2-4-6-20/h2-15,25H,23H2,1H3
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InChIKey |
RMYHYDABGVQXCU-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