GSK1331258

Ligand id: 6252

Name: GSK1331258

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 0
Rotatable bonds 4
Topological polar surface area 37.19
Molecular weight 409.13
XLogP 4.18
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-({4-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]piperazin-1-yl}methyl)-1-methyl-1H-1,3-benzodiazole
Synonyms
GSK 1331258 | GSK-1331258
Database Links
CAS Registry No. 1207197-68-9 (source: Scifinder)
ChEMBL Ligand CHEMBL605836
PubChem CID 46190877
Search Google for chemical match using the InChIKey BQOUGDGGUWVLTD-UHFFFAOYSA-N
Search Google for chemicals with the same backbone BQOUGDGGUWVLTD
Search UniChem for chemical match using the InChIKey BQOUGDGGUWVLTD-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone BQOUGDGGUWVLTD