compound 3 [PMID: 17942791]

Ligand id: 8556

Name: compound 3 [PMID: 17942791]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 3
Rotatable bonds 5
Topological polar surface area 82.45
Molecular weight 370.13
XLogP 5.67
No. Lipinski's rules broken 1

Molecular properties generated using the CDK