BU-E 47

Ligand id: 1219

Name: BU-E 47

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 3
Rotatable bonds 10
Topological polar surface area 91.98
Molecular weight 396.18
XLogP 4.32
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Seifert R, Wenzel-Seifert K, Burckstummer T, Pertz HH, Schunack W, Dove S, Buschauer A, Elz S. (2003)
Multiple differences in agonist and antagonist pharmacology between human and guinea pig histamine H1-receptor.
J Pharmacol Exp Ther305: 1104-1115. [PMID:12626648]