compound 4g [PMID: 22220592]

Ligand id: 9236

Name: compound 4g [PMID: 22220592]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 77.58
Molecular weight 277.13
XLogP 4.4
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Immunopharmacology Comments
Compound 4g is mechanistically similar to AZD4635, a compound that is in Phase 1 clinical trial. AZD4635 blocks adenosine A2A receptor signalling and immune checkpoint inhibition via PD-L1, CTLA-4, and enhances the activity of CD73 inhibition.