compound 22 [PMID: 19899765]

Ligand id: 6562

Name: compound 22 [PMID: 19899765]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 10
Hydrogen bond donors 5
Rotatable bonds 18
Topological polar surface area 167.63
Molecular weight 667.24
XLogP 10.43
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

1. Jullien N, Makritis A, Georgiadis D, Beau F, Yiotakis A, Dive V. (2010)
Phosphinic tripeptides as dual angiotensin-converting enzyme C-domain and endothelin-converting enzyme-1 inhibitors.
J. Med. Chem., 53 (1): 208-20. [PMID:19899765]