General Information of the Compound
| Compound ID |
CP0410126
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| Compound Name |
N-benzhydryl-2-[1-[(4-fluorophenyl)methyl]piperidin-4-yl]acetamide
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| Structure |
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| Formula |
C27H29FN2O
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| Molecular Weight |
416.54
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| Canonical SMILES |
Fc1ccc(CN2CCC(CC(=O)NC(c3ccccc3)c3ccccc3)CC2)cc1
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| InChI |
InChI=1S/C27H29FN2O/c28-25-13-11-22(12-14-25)20-30-17-15-21(16-18-30)19-26(31)29-27(23-7-3-1-4-8-23)24-9-5-2-6-10-24/h1-14,21,27H,15-20H2,(H,29,31)
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| InChIKey |
QUXIGJBRICTBKX-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: PT00871, Sodium-dependent serotonin transporter