Ligand id: 8593

Name: [3H]acetylcholine    

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 2
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 26.3
Molecular weight 146.12
XLogP -0.1
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Lazareno S, Dolezal V, Popham A, Birdsall NJ. (2004)
Thiochrome enhances acetylcholine affinity at muscarinic M4 receptors: receptor subtype selectivity via cooperativity rather than affinity.
Mol Pharmacol, 65: 257-266. [PMID:14722259]