compound 37 [PMID: 16250654]

Ligand id: 2239

Name: compound 37 [PMID: 16250654]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 8
Topological polar surface area 78.51
Molecular weight 497.25
XLogP 7.3
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
(2R)-2-(2,4-difluorophenyl)-2-[(2R,5R)-5-(2,3-dihydro-1H-inden-2-yl)-2-(2-methylpropyl)-3,6-dioxopiperazin-1-yl]-N-propan-2-ylacetamide
Database Links
ChEMBL Ligand CHEMBL196478
PubChem CID 6918854
Search Google for chemical match using the InChIKey QGSYCKKZFPLTMQ-UBFVSLLYSA-N
Search Google for chemicals with the same backbone QGSYCKKZFPLTMQ
Search UniChem for chemical match using the InChIKey QGSYCKKZFPLTMQ-UBFVSLLYSA-N
Search UniChem for chemicals with the same backbone QGSYCKKZFPLTMQ