General Information of the Compound
| Compound ID |
CP0394221
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| Compound Name |
4-tert-butyl-N-(4-(3-(trifluoromethyl)pyridin-2-yl)phenyl)benzamide
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| Structure |
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| Formula |
C23H21F3N2O
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| Molecular Weight |
398.428
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| Canonical SMILES |
CC(C)(C)c1ccc(cc1)C(=O)Nc1ccc(cc1)-c1ncccc1C(F)(F)F
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| InChI |
InChI=1S/C23H21F3N2O/c1-22(2,3)17-10-6-16(7-11-17)21(29)28-18-12-8-15(9-13-18)20-19(23(24,25)26)5-4-14-27-20/h4-14H,1-3H3,(H,28,29)
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| InChIKey |
XGSXYPCLVFLLOW-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