CP608,039

Ligand id: 5598

Name: CP608,039

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 10
Hydrogen bond donors 4
Rotatable bonds 9
Topological polar surface area 175.47
Molecular weight 528.16
XLogP 1.44
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(2S,3S,4R,5R)-3-amino-5-[6-[[5-chloro-2-[(3-methyl-1,2-oxazol-5-yl)oxymethyl]phenyl]methylamino]purin-9-yl]-4-hydroxy-N-methyloxolane-2-carboxamide
Synonyms
CP-608,039
Database Links
CAS Registry No. 331727-55-0 (source: Scifinder)
PubChem CID 73977920
Search Google for chemical match using the InChIKey KXDJDMIUJGBFAV-QYUDBREXSA-N
Search Google for chemicals with the same backbone KXDJDMIUJGBFAV
Search UniChem for chemical match using the InChIKey KXDJDMIUJGBFAV-QYUDBREXSA-N
Search UniChem for chemicals with the same backbone KXDJDMIUJGBFAV