General Information of the Compound
| Compound ID |
CP0443289
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| Compound Name |
2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[[2-(4-methoxyphenyl)-4-(trifluoromethyl)phenyl]methyl]propanamide
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| Structure |
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| Formula |
C25H24F4N2O4S
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| Molecular Weight |
524.536
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| Canonical SMILES |
COc1ccc(cc1)-c1cc(ccc1CNC(=O)C(C)c1ccc(NS(C)(=O)=O)c(F)c1)C(F)(F)F
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| InChI |
InChI=1S/C25H24F4N2O4S/c1-15(17-7-11-23(22(26)12-17)31-36(3,33)34)24(32)30-14-18-4-8-19(25(27,28)29)13-21(18)16-5-9-20(35-2)10-6-16/h4-13,15,31H,14H2,1-3H3,(H,30,32)
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| InChIKey |
MELPGTMHQUBDIX-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