compound 28 [PMID: 18324760]

Ligand id: 6555

Name: compound 28 [PMID: 18324760]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 3
Rotatable bonds 12
Topological polar surface area 133.82
Molecular weight 452.21
XLogP 3.88
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

1. Mores A, Matziari M, Beau F, Cuniasse P, Yiotakis A, Dive V. (2008)
Development of potent and selective phosphinic peptide inhibitors of angiotensin-converting enzyme 2.
J. Med. Chem.51 (7): 2216-26. [PMID:18324760]