compound 11jj [PMID: 1656041]

Ligand id: 3015

Name: compound 11jj [PMID: 1656041]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 11
Topological polar surface area 115.12
Molecular weight 501.15
XLogP 5.72
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(3R)-6-[2-(4-fluorophenyl)-4-[(4-fluorophenyl)sulfanyl]-6-(propan-2-yl)phenoxy]-3,5-dihydroxyhexanoate
Synonyms
compound 10jj [PMID: 1656041] [1] | compound 4jj [PMID: 1656041] [1]
Database Links
ChEMBL Ligand CHEMBL102168
PubChem CID 56947038
Search Google for chemical match using the InChIKey UFSXOKMGOHBXIH-VQCQRNETSA-M
Search Google for chemicals with the same backbone UFSXOKMGOHBXIH
Search UniChem for chemical match using the InChIKey UFSXOKMGOHBXIH-VQCQRNETSA-M
Search UniChem for chemicals with the same backbone UFSXOKMGOHBXIH