compound 11 [PMID: 12812482]

Ligand id: 665

Name: compound 11 [PMID: 12812482]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 9
Hydrogen bond donors 3
Rotatable bonds 9
Topological polar surface area 128.35
Molecular weight 585.1
XLogP 4.52
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-[(2R)-1-(3,4-dichlorophenyl)sulfonyl-3-oxo-2,4-dihydroquinoxalin-2-yl]-N-[2-[4-(4,5-dihydro-1H-imidazol-2-yl)phenyl]ethyl]acetamide
Database Links
BindingDB Ligand 50156455
ChEBI CHEBI:412179
ChEMBL Ligand CHEMBL189123
GtoPdb PubChem SID 135650119
PubChem CID 9916412
Search Google for chemical match using the InChIKey HYJYRDCPGUEYND-XMMPIXPASA-N
Search Google for chemicals with the same backbone HYJYRDCPGUEYND
Search UniChem for chemical match using the InChIKey HYJYRDCPGUEYND-XMMPIXPASA-N
Search UniChem for chemicals with the same backbone HYJYRDCPGUEYND