GSK126

Ligand id: 7012

Name: GSK126

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 8
Hydrogen bond donors 3
Rotatable bonds 8
Topological polar surface area 91.29
Molecular weight 526.31
XLogP 4.53
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-[(2S)-butan-2-yl]-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-3-methyl-6-(6-piperazin-1-ylpyridin-3-yl)indole-4-carboxamide
Synonyms
GSK 126 | GSK-126 | GSK2816126
Database Links
CAS Registry No. 1346574-57-9
ChEMBL Ligand CHEMBL3287735
PubChem CID 68210102
Search Google for chemical match using the InChIKey FKSFKBQGSFSOSM-QFIPXVFZSA-N
Search Google for chemicals with the same backbone FKSFKBQGSFSOSM
Search UniChem for chemical match using the InChIKey FKSFKBQGSFSOSM-QFIPXVFZSA-N
Search UniChem for chemicals with the same backbone FKSFKBQGSFSOSM
Comments
GSK126 is a potent and selective small-molecule inhibitor of EZH2 (KMT6) methyltransferase activity [2]. This is likely to be the ligand with the extended reseaerch code GSK2816126, which has anti-lymphoma potential.