CPI-0610

Ligand id: 9120

Name: CPI-0610

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 81.48
Molecular weight 365.09
XLogP 4.37
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Albrecht BK, Gehling VS, Hewitt MC, Vaswani RG, Côté A, Leblanc Y, Nasveschuk CG, Bellon S, Bergeron L, Campbell R et al.. (2016)
Identification of a Benzoisoxazoloazepine Inhibitor (CPI-0610) of the Bromodomain and Extra-Terminal (BET) Family as a Candidate for Human Clinical Trials.
J. Med. Chem.59 (4): 1330-9. [PMID:26815195]