General Information of the Compound
| Compound ID |
CP0149424
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| Compound Name |
4-(2-methylpropyl)-N-[2-[5-(trifluoromethyl)pyridin-2-yl]sulfonylethyl]benzamide
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| Structure |
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| Formula |
C19H21F3N2O3S
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| Molecular Weight |
414.449
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| Canonical SMILES |
CC(C)Cc1ccc(cc1)C(=O)NCCS(=O)(=O)c1ccc(cn1)C(F)(F)F
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| InChI |
InChI=1S/C19H21F3N2O3S/c1-13(2)11-14-3-5-15(6-4-14)18(25)23-9-10-28(26,27)17-8-7-16(12-24-17)19(20,21)22/h3-8,12-13H,9-11H2,1-2H3,(H,23,25)
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| InChIKey |
KDFWMEDNCJHMME-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