CCT196969

Ligand id: 9815

Name: CCT196969

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 9
Hydrogen bond donors 3
Rotatable bonds 8
Topological polar surface area 110.17
Molecular weight 513.19
XLogP 5.13
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-(5-tert-butyl-2-phenylpyrazol-3-yl)-3-[2-fluoro-4-[(3-oxo-4H-pyrido[2,3-b]pyrazin-8-yl)oxy]phenyl]urea
Comments
CCT196969 is an orally active pan RAF inhibitor that also inhibits SRC family kinases [1]. It was designed to show that the addition of SRC family kinase inhibition alongside RAF inhibition is able to circumvent the paradoxical SRC-mediated re-activation of the RAF-MAP kinase pathway that is observed in tumours with acquired resistance to RAF inhibitors.
Database Links
GtoPdb PubChem SID 354702287
PubChem CID 42628843
Search Google for chemical match using the InChIKey KYYKGSDLXXKQCR-UHFFFAOYSA-N
Search Google for chemicals with the same backbone KYYKGSDLXXKQCR
Search UniChem for chemical match using the InChIKey KYYKGSDLXXKQCR-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone KYYKGSDLXXKQCR