AZ628

Ligand id: 8475

Name: AZ628

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 2
Rotatable bonds 6
Topological polar surface area 85.23
Molecular weight 451.2
XLogP 4.92
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-(2-cyanopropan-2-yl)-N-[4-methyl-3-[(3-methyl-4-oxoquinazolin-6-yl)amino]phenyl]benzamide
Synonyms
AZ 628 | AZ-628
Database Links
CAS Registry No. 878739-06-1
ChEMBL Ligand CHEMBL2144069
PubChem CID 11676786
RCSB PDB Ligand B1E
Search Google for chemical match using the InChIKey ZGBGPEDJXCYQPH-UHFFFAOYSA-N
Search Google for chemicals with the same backbone ZGBGPEDJXCYQPH
Search UniChem for chemical match using the InChIKey ZGBGPEDJXCYQPH-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone ZGBGPEDJXCYQPH
SynPHARM 82209 (in complex with B-Raf proto-oncogene, serine/threonine kinase)
Comments
AZ628 is an experimental inhibitor of RAF kinases [1]. Preclinical data for AZ628 was presented at the AACR Annual Meeting by Shen et al. in 2007 (Linking molecular characteristics to the pharmacological response of a panel of cancer cell lines to the BRAF inhibitor, AZ628).