Ligand id: 4805

Name: pentostatin

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 4
Rotatable bonds 2
Topological polar surface area 112.13
Molecular weight 268.12
XLogP -1.48
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Agarwal RP, Spector T, Parks Jr RE. (1977)
Tight-binding inhibitors--IV. Inhibition of adenosine deaminases by various inhibitors.
Biochem. Pharmacol., 26 (5): 359-67. [PMID:849330]