PF-562271

Ligand id: 9381

Name: PF-562271

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 10
Hydrogen bond donors 3
Rotatable bonds 8
Topological polar surface area 137.59
Molecular weight 507.13
XLogP 2.76
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
N-methyl-N-[3-[[[2-[(2-oxo-1,3-dihydroindol-5-yl)amino]-5-(trifluoromethyl)pyrimidin-4-yl]amino]methyl]pyridin-2-yl]methanesulfonamide
Synonyms
PF-00562271 | PF-562,271 | PF-562,271-26 [1]
Database Links
ChEMBL Ligand CHEMBL1084546
PubChem CID 11713159
RCSB PDB Ligand YAM
Search Google for chemical match using the InChIKey MZDKLVOWGIOKTN-UHFFFAOYSA-N
Search Google for chemicals with the same backbone MZDKLVOWGIOKTN
Search UniChem for chemical match using the InChIKey MZDKLVOWGIOKTN-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone MZDKLVOWGIOKTN
SynPHARM 83989 (in complex with protein tyrosine kinase 2)
Comments
PF-562271 is an experimental ATP-competitive focal adhesion kinase (FAK; official name protein tyrosine kinase 2) inhibitor, designed to investigate the anti-tumour effects of FAK inhibition [1]. Note that this compound may be used as the besylate (PubChem CID 16118986) as detailed in [1].