compound 2 [PMID: 25408830]

Ligand id: 7810

Name: compound 2 [PMID: 25408830]

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 78.1
Molecular weight 345.11
XLogP 2.95
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-(1,3-dimethyl-2-oxobenzimidazol-5-yl)-2,4-dimethylbenzenesulfonamide
Database Links
ChEMBL Ligand CHEMBL1444120
GtoPdb PubChem SID 223366141
PubChem CID 1253361
Search Google for chemical match using the InChIKey HVGVNYJRZJHYBS-UHFFFAOYSA-N
Search Google for chemicals with the same backbone HVGVNYJRZJHYBS
Search UniChem for chemical match using the InChIKey HVGVNYJRZJHYBS-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone HVGVNYJRZJHYBS
Comments
The discovery and activity of this compound is described in Demont et al (2014) [1].