General Information of the Compound
| Compound ID |
CP0512770
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| Compound Name |
1-benzyl-N-[[1-(4-fluorophenyl)cyclopentyl]methyl]piperidine-4-carboxamide
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| Structure |
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| Formula |
C25H31FN2O
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| Molecular Weight |
394.534
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| Canonical SMILES |
Fc1ccc(cc1)C1(CNC(=O)C2CCN(Cc3ccccc3)CC2)CCCC1
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| InChI |
InChI=1S/C25H31FN2O/c26-23-10-8-22(9-11-23)25(14-4-5-15-25)19-27-24(29)21-12-16-28(17-13-21)18-20-6-2-1-3-7-20/h1-3,6-11,21H,4-5,12-19H2,(H,27,29)
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| InChIKey |
ATTQJMOSGZTEIE-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