CDP840

Ligand id: 9330

Name: CDP840

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 1
Hydrogen bond donors 0
Rotatable bonds 7
Topological polar surface area 31.35
Molecular weight 373.2
XLogP 8.29
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
4-[(2R)-2-(3-cyclopentyloxy-4-methoxyphenyl)-2-phenylethyl]pyridine
Synonyms
CDP 840 | CDP-840
Comments
CPD840 is a potent, competitive, orally active, and selective inhibitor of all four PDE4 isoenzymes [3]. It was developed primarily for potential anti-inflammatory effects in asthma and chronic obstructive pulmonary disease (COPD) [2]. The compound is now available for repurposing via the MRC-Industry Asset Sharing Initiative 2016 (full compound list).
Database Links
BindingDB Ligand 50064858
ChEMBL Ligand CHEMBL32442
GtoPdb PubChem SID 318164849
PubChem CID 127928
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Search UniChem for chemicals with the same backbone UTUUPXBCDMQYRR