A331440

Ligand id: 4023

Name: A331440

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 0
Rotatable bonds 7
Topological polar surface area 39.5
Molecular weight 349.22
XLogP 4.76
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Hancock AA, Bennani YL, Bush EN, Esbenshade TA, Faghih R, Fox GB, Jacobson P, Knourek-Segel V, Krueger KM, Nuss ME et al.. (2004)
Antiobesity effects of A-331440, a novel non-imidazole histamine H3 receptor antagonist.
Eur. J. Pharmacol.487 (1-3): 183-97. [PMID:15033391]