Ligand id: 4812

Name: aliskiren

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Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 4
Rotatable bonds 20
Topological polar surface area 146.13
Molecular weight 551.39
XLogP 3.59
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Wuerzner G, Azizi M. (2008)
Renin inhibition with aliskiren.
Clin. Exp. Pharmacol. Physiol., 35 (4): 426-30. [PMID:18307734]