Ligand id: 5143

Name: AZ10417808

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 4
Rotatable bonds 7
Topological polar surface area 125.4
Molecular weight 434.04
XLogP 3.58
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Scott CW, Sobotka-Briner C, Wilkins DE, Jacobs RT, Folmer JJ, Frazee WJ, Bhat RV, Ghanekar SV, Aharony D. (2003)
Novel small molecule inhibitors of caspase-3 block cellular and biochemical features of apoptosis.
J. Pharmacol. Exp. Ther., 304 (1): 433-40. [PMID:12490620]