General Information of the Compound
| Compound ID |
CP0423214
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| Compound Name |
2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[[2-(2-methylcyclohexyl)sulfanyl-6-(trifluoromethyl)pyridin-3-yl]methyl]propanamide
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| Structure |
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| Formula |
C24H29F4N3O3S2
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| Molecular Weight |
547.64
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| Canonical SMILES |
CC(C(=O)NCc1ccc(nc1SC1CCCCC1C)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1
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| InChI |
InChI=1S/C24H29F4N3O3S2/c1-14-6-4-5-7-20(14)35-23-17(9-11-21(30-23)24(26,27)28)13-29-22(32)15(2)16-8-10-19(18(25)12-16)31-36(3,33)34/h8-12,14-15,20,31H,4-7,13H2,1-3H3,(H,29,32)
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| InChIKey |
JXVCKHKRYPJWMM-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