compound 1 [PMID: 1895299]

Ligand id: 2975

Name: compound 1 [PMID: 1895299]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 11
Topological polar surface area 106.89
Molecular weight 421.26
XLogP 3.27
No. Lipinski's rules broken 1

Molecular properties generated using the CDK