CCT241161

Ligand id: 9814

Name: CCT241161

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 9
Hydrogen bond donors 3
Rotatable bonds 9
Topological polar surface area 135.47
Molecular weight 541.19
XLogP 5.54
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-methylsulfanyl-4-[(3-oxo-4H-pyrido[2,3-b]pyrazin-8-yl)oxy]phenyl]urea
Comments
CCT241161 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. CCT241161 is marginally more potent in vitro than the analogue CCT196969 [1].
Database Links
GtoPdb PubChem SID 354702286
PubChem CID 44132853
Search Google for chemical match using the InChIKey DPMYVVGAYAPQNS-UHFFFAOYSA-N
Search Google for chemicals with the same backbone DPMYVVGAYAPQNS
Search UniChem for chemical match using the InChIKey DPMYVVGAYAPQNS-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone DPMYVVGAYAPQNS