compound 3k [PMID: 2231594]

Ligand id: 2978

Name: compound 3k [PMID: 2231594]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 3
Rotatable bonds 9
Topological polar surface area 104.64
Molecular weight 436.18
XLogP 6.14
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(3S)-4-({2-[2-(4-fluoro-3-methylphenyl)-4-methyl-6-(propan-2-yl)phenyl]ethyl}(hydroxy)phosphoryl)-3-hydroxybutanoic acid
Database Links
ChEMBL Ligand CHEMBL101436
PubChem CID 44331589
Search Google for chemical match using the InChIKey IZGDXVLRMHXOJV-SFHVURJKSA-N
Search Google for chemicals with the same backbone IZGDXVLRMHXOJV
Search UniChem for chemical match using the InChIKey IZGDXVLRMHXOJV-SFHVURJKSA-N
Search UniChem for chemicals with the same backbone IZGDXVLRMHXOJV