compound 5m [PMID: 9216829]

Ligand id: 3098

Name: compound 5m [PMID: 9216829]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 18
Topological polar surface area 133.68
Molecular weight 706.33
XLogP 8.41
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[(2-methylpropyl)[(4-phenoxyphenyl)methyl]carbamoyl]cyclobutane-1,2-dicarboxylic acid
Database Links
ChEMBL Ligand CHEMBL304119
PubChem CID 10818542
Search Google for chemical match using the InChIKey ZXCUOCHXNYWBBG-ZQWQDMLBSA-N
Search Google for chemicals with the same backbone ZXCUOCHXNYWBBG
Search UniChem for chemical match using the InChIKey ZXCUOCHXNYWBBG-ZQWQDMLBSA-N
Search UniChem for chemicals with the same backbone ZXCUOCHXNYWBBG