General Information of the Compound
| Compound ID |
CP0464391
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| Compound Name |
2,6-dichloro-N-[[5-(2-methylpropyl)-1-phenylpyrazol-3-yl]methyl]benzenesulfonamide
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| Structure |
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| Formula |
C20H21Cl2N3O2S
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| Molecular Weight |
438.38
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| Canonical SMILES |
CC(C)Cc1cc(CNS(=O)(=O)c2c(Cl)cccc2Cl)nn1-c1ccccc1
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| InChI |
InChI=1S/C20H21Cl2N3O2S/c1-14(2)11-17-12-15(24-25(17)16-7-4-3-5-8-16)13-23-28(26,27)20-18(21)9-6-10-19(20)22/h3-10,12,14,23H,11,13H2,1-2H3
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| InChIKey |
RAPRVFZTSKPDRU-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