General Information of the Compound
| Compound ID |
CP0345647
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| Compound Name |
N-[[5-[5-(4-chlorophenyl)-3-(trifluoromethyl)pyrazol-1-yl]-2-sulfamoylphenyl]methyl]acetamide
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| Structure |
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| Formula |
C19H16ClF3N4O3S
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| Molecular Weight |
472.876
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| Canonical SMILES |
CC(=O)NCc1cc(ccc1S(N)(=O)=O)-n1nc(cc1-c1ccc(Cl)cc1)C(F)(F)F
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| InChI |
InChI=1S/C19H16ClF3N4O3S/c1-11(28)25-10-13-8-15(6-7-17(13)31(24,29)30)27-16(9-18(26-27)19(21,22)23)12-2-4-14(20)5-3-12/h2-9H,10H2,1H3,(H,25,28)(H2,24,29,30)
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| InChIKey |
GTYHRYBZFSGLDS-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