General Information of the Compound
| Compound ID |
CP0353378
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| Compound Name |
N-[(2,4-dichlorophenyl)methyl]-4-(4-fluorophenoxy)piperidine-1-carboxamide
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| Structure |
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| Formula |
C19H19Cl2FN2O2
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| Molecular Weight |
397.277
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| Canonical SMILES |
Fc1ccc(OC2CCN(CC2)C(=O)NCc2ccc(Cl)cc2Cl)cc1
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| InChI |
InChI=1S/C19H19Cl2FN2O2/c20-14-2-1-13(18(21)11-14)12-23-19(25)24-9-7-17(8-10-24)26-16-5-3-15(22)4-6-16/h1-6,11,17H,7-10,12H2,(H,23,25)
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| InChIKey |
NRBGNCRZFNKUSW-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