General Information of the Compound
| Compound ID |
CP0900373
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| Compound Name |
N-(2-(4-Benzylpiperidin-1-yl)ethyl)-[1,1'-biphenyl]-4-carboxamide
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| Structure |
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| Formula |
C27H30N2O
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| Molecular Weight |
398.55
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| Canonical SMILES |
O=C(NCCN1CCC(Cc2ccccc2)CC1)c1ccc(-c2ccccc2)cc1
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| InChI |
InChI=1S/C27H30N2O/c30-27(26-13-11-25(12-14-26)24-9-5-2-6-10-24)28-17-20-29-18-15-23(16-19-29)21-22-7-3-1-4-8-22/h1-14,23H,15-21H2,(H,28,30)
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| InChIKey |
QXORAPZZHCKPIB-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
Protein ID: PT01026, Sodium-dependent noradrenaline transporter
Protein ID: PT00871, Sodium-dependent serotonin transporter