dizocilpine   

GtoPdb Ligand ID: 2403

Synonyms: MK-801
Compound class: Synthetic organic
2D Structure
Click here for structure editor
Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 1
Rotatable bonds 0
Topological polar surface area 12.03
Molecular weight 221.12
XLogP 3.26
No. Lipinski's rules broken 0
SMILES / InChI / InChIKey
Canonical SMILES CC12NC(c3c2cccc3)Cc2c1cccc2
Isomeric SMILES C[C@]12N[C@@H](c3c2cccc3)Cc2c1cccc2
InChI InChI=1S/C16H15N/c1-16-13-8-4-2-6-11(13)10-15(17-16)12-7-3-5-9-14(12)16/h2-9,15,17H,10H2,1H3/t15-,16+/m1/s1
InChI Key LBOJYSIDWZQNJS-CVEARBPZSA-N
Selectivity at ion channels
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Value Parameter Concentration range (M) Reference
Kir3.2 Mm Gating inhibitor Antagonist 3.7 pIC50 - 1
pIC50 3.7 [1]
Voltage: -100.0 mV
GluN2A Hs Channel blocker - - - -
GluN2B Hs Channel blocker - - - -
GluN2C Hs Channel blocker - - - -
GluN2D Hs Channel blocker - - - -