PP2

Ligand id: 9404

Name: PP2

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 69.62
Molecular weight 301.11
XLogP 3
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
1-tert-butyl-3-(4-chlorophenyl)pyrazolo[4,5-e]pyrimidin-4-amine
Database Links
ChEMBL Ligand CHEMBL406845
PubChem CID 4878
Search Google for chemical match using the InChIKey PBBRWFOVCUAONR-UHFFFAOYSA-N
Search Google for chemicals with the same backbone PBBRWFOVCUAONR
Search UniChem for chemical match using the InChIKey PBBRWFOVCUAONR-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone PBBRWFOVCUAONR
SynPHARM 84043 (in complex with LCK proto-oncogene, Src family tyrosine kinase)
Comments
PP2 is a non-selective (pan) inhibitor of Src family tyrosine kinases, used widely to study the biological roles of Src kinases [1].