EI1

Ligand id: 7013

Name: EI1

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 7
Topological polar surface area 86.92
Molecular weight 390.21
XLogP 4.05
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
6-cyano-N-[(4,6-dimethyl-2-oxo-1H-pyridin-3-yl)methyl]-1-pentan-3-ylindole-4-carboxamide
Synonyms
KB-145943
Database Links
CAS Registry No. 1418308-27-6 (source: Scifinder)
PubChem CID 72199293
Search Google for chemical match using the InChIKey PFHDWRIVDDIFRP-UHFFFAOYSA-N
Search Google for chemicals with the same backbone PFHDWRIVDDIFRP
Search UniChem for chemical match using the InChIKey PFHDWRIVDDIFRP-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone PFHDWRIVDDIFRP
Comments
EI1 is a potent and selective small molecule inhibitor of EZH2 (aka KMT6) [1].