General Information of the Compound
| Compound ID |
CP0546185
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| Compound Name |
N-[[2-chloro-4-(methanesulfonamido)phenyl]methyl]-4-(2,2,2-trifluoroethyl)benzamide
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| Structure |
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| Formula |
C17H16ClF3N2O3S
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| Molecular Weight |
420.84
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| Canonical SMILES |
CS(=O)(=O)Nc1ccc(CNC(=O)c2ccc(CC(F)(F)F)cc2)c(Cl)c1
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| InChI |
InChI=1S/C17H16ClF3N2O3S/c1-27(25,26)23-14-7-6-13(15(18)8-14)10-22-16(24)12-4-2-11(3-5-12)9-17(19,20)21/h2-8,23H,9-10H2,1H3,(H,22,24)
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| InChIKey |
VMALQYUTALFADG-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