General Information of the Compound
| Compound ID |
CP0482332
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| Compound Name |
2-(2-ethylbutanoylamino)-N-[3-(trifluoromethyl)phenyl]benzamide
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| Structure |
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| Formula |
C20H21F3N2O2
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| Molecular Weight |
378.394
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| Canonical SMILES |
CCC(CC)C(=O)Nc1ccccc1C(=O)Nc1cccc(c1)C(F)(F)F
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| InChI |
InChI=1S/C20H21F3N2O2/c1-3-13(4-2)18(26)25-17-11-6-5-10-16(17)19(27)24-15-9-7-8-14(12-15)20(21,22)23/h5-13H,3-4H2,1-2H3,(H,24,27)(H,25,26)
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| InChIKey |
TVOTZIGTEZBARS-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