2-chloroadenosine

Ligand Id: 372
Ligand name 2-chloroadenosine

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

Summary Biological activity References Structure Similar ligands Suppliers
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
2-(6-amino-2-chloro-purin-9-yl)-5-(hydroxymethyl)oxolane-3,4-diol
2Cl-Ado
CADO
Database Links
BindingDB Ligand 50335299
ChEBI CHEBI:140636
ChEMBL Ligand 319336, 350770, 416492, 140636, 240120
PubChem CID 8974
Search ChemSpider using InChI key BIXYYZIIJIXVFW-UUOKFMHZSA-N
Search Google for chemicals with the same backbone BIXYYZIIJIXVFW
ZINC ZINC03875976
iPHACE 2RDY9GBJ

Please note: some links may refer to related isomers. For more details please contact: enquiries@guidetopharmacology.org