General Information of the Compound
| Compound ID |
CP0539683
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| Compound Name |
2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[[2-[(4-fluorophenyl)methoxy]-4-(trifluoromethyl)phenyl]methyl]propanamide
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| Structure |
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| Formula |
C25H23F5N2O4S
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| Molecular Weight |
542.526
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| Canonical SMILES |
CC(C(=O)NCc1ccc(cc1OCc1ccc(F)cc1)C(F)(F)F)c1ccc(NS(C)(=O)=O)c(F)c1
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| InChI |
InChI=1S/C25H23F5N2O4S/c1-15(17-6-10-22(21(27)11-17)32-37(2,34)35)24(33)31-13-18-5-7-19(25(28,29)30)12-23(18)36-14-16-3-8-20(26)9-4-16/h3-12,15,32H,13-14H2,1-2H3,(H,31,33)
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| InChIKey |
PASMYBFQAZZAIR-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