Ligand id: 5115

Name: 3-deazaadenosine

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 126.65
Molecular weight 266.1
XLogP -1.38
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

1. Guranowski A, Montgomery JA, Cantoni GL, Chiang PK. (1981)
Adenosine analogues as substrates and inhibitors of S-adenosylhomocysteine hydrolase.
Biochemistry, 20 (1): 110-5. [PMID:7470463]