carbachol

Ligand id: 298

Name: carbachol

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 4
Topological polar surface area 52.32
Molecular weight 147.11
XLogP -0.98
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (source: FDA (1972))
IUPAC Name
2-carbamoyloxyethyl-trimethylazanium
International Nonproprietary Names
INN number INN
383 carbachol
Synonyms
Carbastat®
Carboptic®
Database Links
BindingDB Ligand 50014555
CAS Registry No. 51-83-2
ChEMBL Ligand CHEMBL965
DrugBank Ligand DB00411
PharmGKB Drug PA448784
PubChem CID 2551
RCSB PDB Ligand CCE
Search Google for chemical match using the InChIKey VPJXQGSRWJZDOB-UHFFFAOYSA-O
Search Google for chemicals with the same backbone VPJXQGSRWJZDOB
Search PubMed clinical trials carbachol
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Wikipedia Carbachol
Comments
Carbachol is a cholinergic agonist acting at both muscarinic and nicotinic receptors.