TGF-beta RI kinase inhibitor

Ligand id: 6050

Name: TGF-beta RI kinase inhibitor

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 4
Hydrogen bond donors 1
Rotatable bonds 2
Topological polar surface area 54.46
Molecular weight 272.11
XLogP 4.16
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
4-[5-(pyridin-2-yl)-1H-pyrazol-4-yl]quinoline
Synonyms
LY 364947 | LY-364947 | TbetaR-I inhibitor
Database Links
CAS Registry No. 396129-53-6
ChEMBL Ligand CHEMBL261454
DrugBank Ligand DB03921
PubChem CID 447966
RCSB PDB Ligand PY1
Search Google for chemical match using the InChIKey IBCXZJCWDGCXQT-UHFFFAOYSA-N
Search Google for chemicals with the same backbone IBCXZJCWDGCXQT
Search UniChem for chemical match using the InChIKey IBCXZJCWDGCXQT-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone IBCXZJCWDGCXQT
SynPHARM 80583 (in complex with transforming growth factor beta receptor 1)
Comments
Selective inhibitor of TGF-βRI