KD025

Ligand id: 9558

Name: KD025

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 7
Hydrogen bond donors 3
Rotatable bonds 8
Topological polar surface area 104.82
Molecular weight 452.2
XLogP 5.53
No. Lipinski's rules broken 1

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
2-[3-[4-(1H-indazol-5-ylamino)quinazolin-2-yl]phenoxy]-N-propan-2-ylacetamide
Synonyms
KD-025 | SLx 2119 | SLx2119
Database Links
ChEMBL Ligand CHEMBL2005186
PubChem CID 11950170
Search Google for chemical match using the InChIKey GKHIVNAUVKXIIY-UHFFFAOYSA-N
Search Google for chemicals with the same backbone GKHIVNAUVKXIIY
Search UniChem for chemical match using the InChIKey GKHIVNAUVKXIIY-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone GKHIVNAUVKXIIY
Comments
KD025 is a selective inhbitor of Rho associated coiled-coil containing protein kinase 2 (ROCK2) [1], with clinical anti-inflammatory/immunomodulatory potential.