compound 7 [PMID: 2909732]

Ligand id: 3020

Name: compound 7 [PMID: 2909732]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 7
Topological polar surface area 74.6
Molecular weight 236.1
XLogP 2.61
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(3R)-3-hydroxy-5-oxo-7-phenylheptanoic acid
Database Links
ChEMBL Ligand CHEMBL60053
GtoPdb PubChem SID 135649741
PubChem CID 44303431
Search Google for chemical match using the InChIKey AOBNEADIHQEJLV-GFCCVEGCSA-N
Search Google for chemicals with the same backbone AOBNEADIHQEJLV
Search UniChem for chemical match using the InChIKey AOBNEADIHQEJLV-GFCCVEGCSA-N
Search UniChem for chemicals with the same backbone AOBNEADIHQEJLV