acetylcholine


SMILES CC(=O)OCC[N+](C)(C)C
InChIKey OIPILFWXSMYKGL-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 3
Molecular weight (Da) 146.1

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Endogenous
Approved drug Yes

Database connections

Structure pdb 7T90 7T8X 7TRS 7T94 7T96
Ligand site mutations M1 M2 M3 M4

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
CB2 CNR2 Human Cannabinoid A pIC50 5.57 5.57 5.57 ChEMBL
CB1 CNR1 Human Cannabinoid A pIC50 9.22 9.22 9.22 ChEMBL