General Information of the Compound
| Compound ID |
CP0453301
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| Compound Name |
N-[4-[5-amino-1-(4-methylphenyl)pyrazol-3-yl]phenyl]-4-(dimethylamino)benzenesulfonamide
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| Structure |
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| Formula |
C24H25N5O2S
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| Molecular Weight |
447.564
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| Canonical SMILES |
CN(C)c1ccc(cc1)S(=O)(=O)Nc1ccc(cc1)-c1cc(N)n(n1)-c1ccc(C)cc1
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| InChI |
InChI=1S/C24H25N5O2S/c1-17-4-10-21(11-5-17)29-24(25)16-23(26-29)18-6-8-19(9-7-18)27-32(30,31)22-14-12-20(13-15-22)28(2)3/h4-16,27H,25H2,1-3H3
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| InChIKey |
JFBFUYOBEDNFGP-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