Ligand id: 7095

Name: pentoxifylline

IUPHAR Pharmacology Education Project (PEP) logo

View more information in the IUPHAR Pharmacology Education Project: pentoxifylline

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 5
Topological polar surface area 75.51
Molecular weight 278.14
XLogP -0.1
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

View interactive charts of activity data from GtoPdb and ChEMBL (where available) across species

Bioactivity Comments
Although we have affinity data for this drug at the α2B-AR, we have been unable to find publicly available bioactivity data for this drug to substantiate its inhibition of PDEs. We have not tagged a primary drug target.
Selectivity at GPCRs
Key to terms and symbols Click column headers to sort
Target Sp. Type Action Affinity Units Concentration range (M) Reference
A2B receptor Hs Antagonist Antagonist 5.3 pKi - 2
pKi 5.3 (Ki 5.18x10-6 M) [2]