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 1.84
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
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.
Database Links
GtoPdb PubChem SID 249565734
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

Product suppliers

Tocris
PF 06447475
Cat. No. 5716