Ligand id: 3534

Name: sufentanil

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 9
Topological polar surface area 61.02
Molecular weight 386.2
XLogP 4.8
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Volpe DA, McMahon Tobin GA, Mellon RD, Katki AG, Parker RJ, Colatsky T, Kropp TJ, Verbois SL. (2011)
Uniform assessment and ranking of opioid μ receptor binding constants for selected opioid drugs.
Regul. Toxicol. Pharmacol., 59 (3): 385-90. [PMID:21215785]
2. Yeadon M, Kitchen I. (1988)
Comparative binding of mu and delta selective ligands in whole brain and pons/medulla homogenates from rat: affinity profiles of fentanyl derivatives.
Neuropharmacology, 27 (4): 345-8. [PMID:2843777]