PF-06447475

Ligand id: 8054

Name: PF-06447475

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 6
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 77.83
Molecular weight 305.13
XLogP 1.85
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
3-[4-(morpholin-4-yl)-7H-pyrrolo[2,3-d]pyrimidin-5-yl]benzonitrile
Database Links
PubChem CID 72706840
RCSB PDB Ligand 3FE
Search Google for chemical match using the InChIKey BHTWDJBVZQBRKP-UHFFFAOYSA-N
Search Google for chemicals with the same backbone BHTWDJBVZQBRKP
Search UniChem for chemical match using the InChIKey BHTWDJBVZQBRKP-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone BHTWDJBVZQBRKP
Comments
PF-06447475 has been identified as a potent, brain-pentrant inhibitor of the serine-threonine kinase, leucine-rich repeat kinase 2 (LRRK2) [1] . The compound does not have favourable pharmacokinetic properties to progress clinical development, but it is a useful tool for the investigation of central and peripheral LRRK2 function.