General Information of the Compound
| Compound ID |
CP0150166
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| Compound Name |
1-(2-benzhydryloxyethyl)-N-[2-(4-fluorophenyl)ethyl]piperidin-4-amine
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| Structure |
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| Formula |
C28H33FN2O
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| Molecular Weight |
432.583
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| Canonical SMILES |
Fc1ccc(CCNC2CCN(CCOC(c3ccccc3)c3ccccc3)CC2)cc1
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| InChI |
InChI=1S/C28H33FN2O/c29-26-13-11-23(12-14-26)15-18-30-27-16-19-31(20-17-27)21-22-32-28(24-7-3-1-4-8-24)25-9-5-2-6-10-25/h1-14,27-28,30H,15-22H2
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| InChIKey |
AKCNZFOHJFSRSN-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: PT00884, Sodium-dependent dopamine transporter
Protein ID: PT01026, Sodium-dependent noradrenaline transporter
Protein ID: PT00871, Sodium-dependent serotonin transporter