compound 5j [PMID: 9216829]

Ligand id: 3099

Name: compound 5j [PMID: 9216829]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 20
Topological polar surface area 133.68
Molecular weight 706.33
XLogP 8.95
No. Lipinski's rules broken 2

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(1S,2S,3S,4S)-3,4-bis({butyl[(4-phenoxyphenyl)methyl]carbamoyl})cyclobutane-1,2-dicarboxylic acid
Database Links
ChEMBL Ligand CHEMBL303461
PubChem CID 10699948
Search Google for chemical match using the InChIKey GNPHAOQLHRZODS-ZQWQDMLBSA-N
Search Google for chemicals with the same backbone GNPHAOQLHRZODS
Search UniChem for chemical match using the InChIKey GNPHAOQLHRZODS-ZQWQDMLBSA-N
Search UniChem for chemicals with the same backbone GNPHAOQLHRZODS