GSK-3beta inhibitor XI

Ligand id: 5981

Name: GSK-3beta inhibitor XI

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 2
Rotatable bonds 5
Topological polar surface area 110
Molecular weight 349.12
XLogP -0.06
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-[1-(3-hydroxypropyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-4-(pyrazin-2-yl)-2,5-dihydro-1H-pyrrole-2,5-dione
Synonyms
GSK-3b inhibitor XI
Database Links
CAS Registry No. 626604-39-5
ChEMBL Ligand CHEMBL272629
PubChem CID 10020713
Search Google for chemical match using the InChIKey ZDEJZKULWCZIHL-UHFFFAOYSA-N
Search Google for chemicals with the same backbone ZDEJZKULWCZIHL
Search UniChem for chemical match using the InChIKey ZDEJZKULWCZIHL-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone ZDEJZKULWCZIHL
Comments
The synthesis and discovery of this compound is described in [3] where it is compound 33.