VEGF receptor tyrosine kinase inhibitor II

Ligand id: 6056

Name: VEGF receptor tyrosine kinase inhibitor II

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 2
Rotatable bonds 6
Topological polar surface area 54.02
Molecular weight 337.1
XLogP 5.13
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-(4-chlorophenyl)-2-[(pyridin-4-ylmethyl)amino]benzamide
Synonyms
AG-E-85378
Database Links
CAS Registry No. 269390-69-4
ChEMBL Ligand CHEMBL101683
DrugBank Ligand DB07288
PubChem CID 9797919
RCSB PDB Ligand 8ST
Search Google for chemical match using the InChIKey GGPZCOONYBPZEW-UHFFFAOYSA-N
Search Google for chemicals with the same backbone GGPZCOONYBPZEW
Search UniChem for chemical match using the InChIKey GGPZCOONYBPZEW-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone GGPZCOONYBPZEW
Comments
This is compound 10 in [2]. The article does not clearly indicate the speciesused to derive the VEGFR2 protein used in the kinase assays. We map this data to the human protein.