axitinib

Ligand id: 5659

Name: axitinib

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 2
Rotatable bonds 6
Topological polar surface area 95.97
Molecular weight 386.12
XLogP 5.77
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
Approved drug? Yes (source: FDA and EMA (2012))
IUPAC Name
N-methyl-2-({3-[(E)-2-(pyridin-2-yl)ethenyl]-1H-indazol-6-yl}sulfanyl)benzamide
International Nonproprietary Names
INN number INN
8720 axitinib
Synonyms
AG 013736
AG-013736
AG013736
Inlyta®
Database Links
CAS Registry No. 319460-85-0
ChEMBL Ligand CHEMBL1289926
DrugBank Ligand DB06626
PubChem CID 6450551
RCSB PDB Ligand AXI
Search Google for chemical match using the InChIKey RITAVMQDGBJQJZ-FMIVXFBMSA-N
Search Google for chemicals with the same backbone RITAVMQDGBJQJZ
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Wikipedia Axitinib
Comments
Axitinib is a Type-1 kinase inhibitor. Axitinib inhibits several receptor tyrosine kinases including VEGFR-1, VEGFR-2, VEGFR-3, platelet derived growth factor receptor (PDGFR), and cKIT.