phencyclidine   Click here for help

GtoPdb Ligand ID: 4282

PDB Ligand
Compound class: Synthetic organic
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2D Structure
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Physico-chemical Properties
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Hydrogen bond acceptors 1
Hydrogen bond donors 0
Rotatable bonds 2
Topological polar surface area 3.24
Molecular weight 243.2
XLogP 4.22
No. Lipinski's rules broken 0
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Canonical SMILES C1CCC(CC1)(N1CCCCC1)c1ccccc1
Isomeric SMILES C1CCC(CC1)(N1CCCCC1)c1ccccc1
InChI InChI=1S/C17H25N/c1-4-10-16(11-5-1)17(12-6-2-7-13-17)18-14-8-3-9-15-18/h1,4-5,10-11H,2-3,6-9,12-15H2
Selectivity at ion channels
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Target Sp. Type Action Value Parameter Concentration range (M) Reference
GluN2C Hs Channel blocker - 7.1 pIC50 - 1
pIC50 7.1 (IC50 7.7x10-8 M) [1]
Description: Measured vs. exogenously expressed zeta1/epsilon3 (GRIN1/GRIN2C) subunits, at pH 6.9
GluN2A Hs Channel blocker - - - -
GluN2B Hs Channel blocker - - - -
GluN2D Hs Channel blocker - - - -