compound 11nn [PMID: 1656041]

Ligand id: 3014

Name: compound 11nn [PMID: 1656041]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 9
Topological polar surface area 102.71
Molecular weight 426.17
XLogP 4.15
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(3R)-6-{[2-(4-fluorophenyl)-4-(propan-2-yl)quinolin-3-yl]oxy}-3,5-dihydroxyhexanoate
Database Links
ChEMBL Ligand CHEMBL101497
GtoPdb PubChem SID 135649770
PubChem CID 56947040
Search Google for chemical match using the InChIKey WFJBUGLKYOMEIA-QNSVNVJESA-M
Search Google for chemicals with the same backbone WFJBUGLKYOMEIA
Search UniChem for chemical match using the InChIKey WFJBUGLKYOMEIA-QNSVNVJESA-M
Search UniChem for chemicals with the same backbone WFJBUGLKYOMEIA