General Information of the Compound
| Compound ID |
CP0380459
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| Compound Name |
2-[3,5-bis(trifluoromethyl)phenoxy]-N-(4-fluorophenyl)-N-piperidin-4-ylacetamide
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| Structure |
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| Formula |
C21H19F7N2O2
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| Molecular Weight |
464.381
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| Canonical SMILES |
Fc1ccc(cc1)N(C1CCNCC1)C(=O)COc1cc(cc(c1)C(F)(F)F)C(F)(F)F
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| InChI |
InChI=1S/C21H19F7N2O2/c22-15-1-3-16(4-2-15)30(17-5-7-29-8-6-17)19(31)12-32-18-10-13(20(23,24)25)9-14(11-18)21(26,27)28/h1-4,9-11,17,29H,5-8,12H2
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| InChIKey |
KHZGJOOZZRYILL-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