LY3009120

Ligand id: 8943

Name: LY3009120

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 8
Topological polar surface area 91.83
Molecular weight 424.24
XLogP 4.94
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-(3,3-dimethylbutyl)-3-[2-fluoro-4-methyl-5-[7-methyl-2-(methylamino)pyrido[2,3-d]pyrimidin-6-yl]phenyl]urea
Synonyms
LY-3009120
Database Links
CAS Registry No. 1454682-72-4 (source: PubChem)
PubChem CID 71721540
RCSB PDB Ligand 4Z5
Search Google for chemical match using the InChIKey HHCBMISMPSAZBF-UHFFFAOYSA-N
Search Google for chemicals with the same backbone HHCBMISMPSAZBF
Search UniChem for chemical match using the InChIKey HHCBMISMPSAZBF-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone HHCBMISMPSAZBF
SynPHARM 83194 (in complex with B-Raf proto-oncogene, serine/threonine kinase)
Comments
LY3009120 is a pan-RAF kinase and RAF dimer inhibitor [1].