General Information of the Compound
| Compound ID |
CP0418910
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| Compound Name |
4-Benzyl-1-[3-phenylpropoxy)propyl]piperidine
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| Synonyms |
4-Benzyl-1-[3-phenylpropoxy)propyl]piperidine
CHEMBL513620
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| Structure |
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| Formula |
C24H33NO
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| Molecular Weight |
351.534
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| Canonical SMILES |
C(COCCCc1ccccc1)CN1CCC(Cc2ccccc2)CC1
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| InChI |
InChI=1S/C24H33NO/c1-3-9-22(10-4-1)13-7-19-26-20-8-16-25-17-14-24(15-18-25)21-23-11-5-2-6-12-23/h1-6,9-12,24H,7-8,13-21H2
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| InChIKey |
XBQBYNHFYXHMHB-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
Clinical Information about the Compound