2-chloroadenosine

Ligand id: 372

Name: 2-chloroadenosine

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 9
Hydrogen bond donors 4
Rotatable bonds 2
Topological polar surface area 139.54
Molecular weight 301.06
XLogP -1.29
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Metabolite or derivative
IUPAC Name
(2R,3R,4S,5R)-2-(6-amino-2-chloropurin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
Synonyms
2Cl-Ado
CADO
Database Links
BindingDB Ligand 50335299
CAS Registry No. 146-77-0 (source: Scifinder)
ChEMBL Ligand CHEMBL285819
PubChem CID 8974
Search Google for chemical match using the InChIKey BIXYYZIIJIXVFW-UUOKFMHZSA-N
Search Google for chemicals with the same backbone BIXYYZIIJIXVFW