Ligand id: 9537

Name: atracurium

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 26
Topological polar surface area 126.44
Molecular weight 928.51
XLogP 6.34
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Immunopharmacology Comments
Neuromuscular blocking agents bind the nicotinic acetylcholine receptor α1 (nAChRα1), a receptor also involved in inflammatory signaling. Rodent models of acute lung injury suggest that the nAChRα1-mediated antiinflammatory action (reduced cytokine release) of these agents may be lung protective [2].