General Information of the Compound
| Compound ID |
CP0531059
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| Compound Name |
1-benzyl-N-[[1-(4-fluorophenyl)cyclohexyl]methyl]piperidine-2-carboxamide
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| Structure |
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| Formula |
C26H33FN2O
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| Molecular Weight |
408.561
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| Canonical SMILES |
Fc1ccc(cc1)C1(CNC(=O)C2CCCCN2Cc2ccccc2)CCCCC1
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| InChI |
InChI=1S/C26H33FN2O/c27-23-14-12-22(13-15-23)26(16-6-2-7-17-26)20-28-25(30)24-11-5-8-18-29(24)19-21-9-3-1-4-10-21/h1,3-4,9-10,12-15,24H,2,5-8,11,16-20H2,(H,28,30)
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| InChIKey |
BPPAJOIICZUQBF-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