General Information of the Compound
| Compound ID |
CP0512493
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| Compound Name |
1-(1-benzylpiperidin-4-yl)-3-[1-(4-fluorophenyl)cyclohexyl]propan-1-one
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| Structure |
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| Formula |
C27H34FNO
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| Molecular Weight |
407.573
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| Canonical SMILES |
Fc1ccc(cc1)C1(CCC(=O)C2CCN(Cc3ccccc3)CC2)CCCCC1
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| InChI |
InChI=1S/C27H34FNO/c28-25-11-9-24(10-12-25)27(16-5-2-6-17-27)18-13-26(30)23-14-19-29(20-15-23)21-22-7-3-1-4-8-22/h1,3-4,7-12,23H,2,5-6,13-21H2
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| InChIKey |
OVEAWGMEVJJGNZ-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