azathioprine

Ligand id: 7120

Name: azathioprine

IUPHAR Pharmacology Education Project (PEP) logo

View more information in the IUPHAR Pharmacology Education Project: azathioprine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 143.4
Molecular weight 277.04
XLogP 0.25
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

References
1. Jones JE, Causey CP, Knuckley B, Slack-Noyes JL, Thompson PR. (2009)
Protein arginine deiminase 4 (PAD4): Current understanding and future therapeutic potential.
Curr Opin Drug Discov Devel12 (5): 616-27. [PMID:19736621]
2. Knuckley B, Luo Y, Thompson PR. (2008)
Profiling Protein Arginine Deiminase 4 (PAD4): a novel screen to identify PAD4 inhibitors.
Bioorg. Med. Chem.16 (2): 739-45. [PMID:17964793]