General Information of the Compound
| Compound ID |
CP0475750
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| Compound Name |
4-Dimethylamino-N-[4-(5-methylamino-1-p-tolyl-1H-pyrazol-3-yl)-phenyl]-benzenesulfonamide
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| Structure |
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| Formula |
C25H27N5O2S
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| Molecular Weight |
461.591
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| Canonical SMILES |
CNc1cc(nn1-c1ccc(C)cc1)-c1ccc(NS(=O)(=O)c2ccc(cc2)N(C)C)cc1
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| InChI |
InChI=1S/C25H27N5O2S/c1-18-5-11-22(12-6-18)30-25(26-2)17-24(27-30)19-7-9-20(10-8-19)28-33(31,32)23-15-13-21(14-16-23)29(3)4/h5-17,26,28H,1-4H3
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| InChIKey |
UXKFMDPONNJUQW-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