tepotinib

Ligand id: 8293

Name: tepotinib

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 0
Rotatable bonds 7
Topological polar surface area 82.35
Molecular weight 492.23
XLogP 4.62
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-[1-[[3-[5-[(1-methylpiperidin-4-yl)methoxy]pyrimidin-2-yl]phenyl]methyl]-6-oxopyridazin-3-yl]benzonitrile
International Nonproprietary Names
INN number INN
9934 tepotinib
Synonyms
compound 22 [PMID: 25736998] | EMD 1214063 | EMD-1214063 | MSC2156119 | MSC2156119J
Database Links
CAS Registry No. 1100598-32-0 (source: Scifinder)
PubChem CID 25171648
RCSB PDB Ligand 3E8
Search Google for chemical match using the InChIKey AHYMHWXQRWRBKT-UHFFFAOYSA-N
Search Google for chemicals with the same backbone AHYMHWXQRWRBKT
Search PubMed clinical trials tepotinib
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Search UniChem for chemical match using the InChIKey AHYMHWXQRWRBKT-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone AHYMHWXQRWRBKT
SynPHARM 83121 (in complex with MET proto-oncogene, receptor tyrosine kinase)
Comments
Tepotinib is a potent and selective, orally available inhibitor of MET tyrosine kinase [1], being investigated for its potential antineoplastic activity.