General Information of the Compound
| Compound ID |
CP0433262
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| Compound Name |
2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[[2-[2-(4-fluorophenyl)ethyl]-6-(trifluoromethyl)pyridin-3-yl]methyl]propanamide
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| Structure |
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| Formula |
C25H24F5N3O3S
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| Molecular Weight |
541.542
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| Canonical SMILES |
CC(C(=O)NCc1ccc(nc1CCc1ccc(F)cc1)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1
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| InChI |
InChI=1S/C25H24F5N3O3S/c1-15(17-6-11-22(20(27)13-17)33-37(2,35)36)24(34)31-14-18-7-12-23(25(28,29)30)32-21(18)10-5-16-3-8-19(26)9-4-16/h3-4,6-9,11-13,15,33H,5,10,14H2,1-2H3,(H,31,34)
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| InChIKey |
WUWWDKOTAMMDBG-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