General Information of the Compound
| Compound ID |
CP0222929
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| Compound Name |
N-[[5-[5-(4-methylphenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-sulfamoylphenyl]methyl]acetamide
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| Structure |
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| Formula |
C20H19F3N4O3S
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| Molecular Weight |
452.458
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| Canonical SMILES |
CC(=O)NCc1cc(ccc1S(N)(=O)=O)-n1nc(cc1-c1ccc(C)cc1)C(F)(F)F
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| InChI |
InChI=1S/C20H19F3N4O3S/c1-12-3-5-14(6-4-12)17-10-19(20(21,22)23)26-27(17)16-7-8-18(31(24,29)30)15(9-16)11-25-13(2)28/h3-10H,11H2,1-2H3,(H,25,28)(H2,24,29,30)
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| InChIKey |
DYOGJSCHXUCRIS-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