alogliptin

Ligand id: 6319

Name: alogliptin

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 93.67
Molecular weight 339.17
XLogP 1.32
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Xie H, Zeng L, Zeng S, Lu X, Zhang G, Zhao X, Cheng N, Tu Z, Li Z, Xu H et al.. (2012)
Novel pyrrolopyrimidine analogues as potent dipeptidyl peptidase IV inhibitors based on pharmacokinetic property-driven optimization.
Eur J Med Chem52: 205-12. [PMID:22475866]