sapitinib

Ligand id: 7717

Name: sapitinib

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 2
Rotatable bonds 8
Topological polar surface area 88.61
Molecular weight 473.16
XLogP 2.81
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-[4-[4-[(3-chloro-2-fluorophenyl)amino]-7-methoxyquinazolin-6-yl]oxypiperidin-1-yl]-N-methylacetamide
International Nonproprietary Names
INN number INN
9528 sapitinib
Synonyms
AZD-8931 | AZD8931
Database Links
CAS Registry No. 848942-61-0
ChEMBL Ligand CHEMBL2408045
PubChem CID 11488320
Search Google for chemical match using the InChIKey DFJSJLGUIXFDJP-UHFFFAOYSA-N
Search Google for chemicals with the same backbone DFJSJLGUIXFDJP
Search PubMed clinical trials sapitinib
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Search UniChem for chemical match using the InChIKey DFJSJLGUIXFDJP-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone DFJSJLGUIXFDJP
Comments
Sapitinib is an inhibitor of all members of the epidermal growth factor receptor (EGFR) receptor tyrosine kinase family [1] and was investigated as a potential oncology therapeutic. This compound is now included in AstaZeneca's Open Innovation Pharmacology Toolbox.