compound 19 [PMID: 8831774]

Ligand id: 8569

Name: compound 19 [PMID: 8831774]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 9
Hydrogen bond donors 4
Rotatable bonds 17
Topological polar surface area 133.83
Molecular weight 497.25
XLogP 5.87
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

1. Li Z, Ortega-Vilain AC, Patil GS, Chu DL, Foreman JE, Eveleth DD, Powers JC. (1996)
Novel peptidyl alpha-keto amide inhibitors of calpains and other cysteine proteases.
J. Med. Chem., 39 (20): 4089-98. [PMID:8831774]