General Information of the Compound
| Compound ID |
CP0521157
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| Compound Name |
N-[4-[5-amino-1-(4-methylphenyl)pyrazol-3-yl]phenyl]-4-methylbenzenesulfonamide
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| Structure |
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| Formula |
C23H22N4O2S
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| Molecular Weight |
418.522
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| Canonical SMILES |
Cc1ccc(cc1)-n1nc(cc1N)-c1ccc(NS(=O)(=O)c2ccc(C)cc2)cc1
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| InChI |
InChI=1S/C23H22N4O2S/c1-16-3-11-20(12-4-16)27-23(24)15-22(25-27)18-7-9-19(10-8-18)26-30(28,29)21-13-5-17(2)6-14-21/h3-15,26H,24H2,1-2H3
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| InChIKey |
PHGNPTHVQLHDIB-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