General Information of the Compound
| Compound ID |
CP0374948
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| Compound Name |
N-(3-acetylphenyl)-1-[3,5-bis(trifluoromethyl)benzoyl]piperidine-3-carboxamide
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| Structure |
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| Formula |
C23H20F6N2O3
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| Molecular Weight |
486.412
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| Canonical SMILES |
CC(=O)c1cccc(NC(=O)C2CCCN(C2)C(=O)c2cc(cc(c2)C(F)(F)F)C(F)(F)F)c1
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| InChI |
InChI=1S/C23H20F6N2O3/c1-13(32)14-4-2-6-19(10-14)30-20(33)15-5-3-7-31(12-15)21(34)16-8-17(22(24,25)26)11-18(9-16)23(27,28)29/h2,4,6,8-11,15H,3,5,7,12H2,1H3,(H,30,33)
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| InChIKey |
QTNWXMYIHXVYIP-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