8-pCPT-2'-O-Me-cAMP

Ligand id: 5172

Name: 8-pCPT-2'-O-Me-cAMP

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 11
Hydrogen bond donors 2
Rotatable bonds 4
Topological polar surface area 178.95
Molecular weight 485.03
XLogP 0.38
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
8-(4-chlorophenyl)sulfanyl-9-[(1R,6R,8R,9R)-3-hydroxy-9-methoxy-3-oxo-2,4,7-trioxa-3$l^{5}-phosphabicyclo[4.3.0]nonan-8-yl]purin-6-amine
Synonyms
8CPT-2MecAMP | CPT-2'OMe-cAMP
Database Links
CAS Registry No. 510774-50-2
ChEMBL Ligand CHEMBL397985
PubChem CID 9913268
RCSB PDB Ligand H07
Search Google for chemical match using the InChIKey BCGHHRAUZWOTNH-XNIJJKJLSA-N
Search Google for chemicals with the same backbone BCGHHRAUZWOTNH
Search UniChem for chemical match using the InChIKey BCGHHRAUZWOTNH-XNIJJKJLSA-N
Search UniChem for chemicals with the same backbone BCGHHRAUZWOTNH