BAY-524

Ligand id: 9127

Name: BAY-524

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 9
Topological polar surface area 96.21
Molecular weight 482.19
XLogP 3.33
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-[1-[(4-ethoxy-2,6-difluorophenyl)methyl]-5-methoxy-4-methylpyrazol-3-yl]-5-methoxy-N-pyridin-4-ylpyrimidin-4-amine
Database Links
PubChem CID 71611179
Search Google for chemical match using the InChIKey LMRCQVHTZUUHFN-UHFFFAOYSA-N
Search Google for chemicals with the same backbone LMRCQVHTZUUHFN
Search UniChem for chemical match using the InChIKey LMRCQVHTZUUHFN-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone LMRCQVHTZUUHFN
Comments
BAY-524 is a Bub1 kinase inhibitor [1]. This can be used as a tool compound for investigating Bub1 kinase function.