General Information of the Compound
| Compound ID |
CP0470499
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| Compound Name |
N-[[4-methyl-5-(2-methylpropyl)-1-phenylpyrazol-3-yl]methyl]benzenesulfonamide
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| Structure |
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| Formula |
C21H25N3O2S
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| Molecular Weight |
383.517
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| Canonical SMILES |
CC(C)Cc1c(C)c(CNS(=O)(=O)c2ccccc2)nn1-c1ccccc1
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| InChI |
InChI=1S/C21H25N3O2S/c1-16(2)14-21-17(3)20(23-24(21)18-10-6-4-7-11-18)15-22-27(25,26)19-12-8-5-9-13-19/h4-13,16,22H,14-15H2,1-3H3
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| InChIKey |
ZYYWHOYJTDUWTN-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