GSK429286A

Ligand id: 9356

Name: GSK429286A

2D Structure

Calculated Physico-chemical Properties
Hydrogen bond acceptors	6
Hydrogen bond donors	3
Rotatable bonds	5
Topological polar surface area	86.88
Molecular weight	432.12
XLogP	5.05
No. Lipinski's rules broken	1

Molecular properties generated using the CDK

Classification
Compound class	Synthetic organic

IUPAC Name
N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydro-1H-pyridine-5-carboxamide

IUPAC Name

N-(6-fluoro-1H-indazol-5-yl)-6-methyl-2-oxo-4-[4-(trifluoromethyl)phenyl]-3,4-dihydro-1H-pyridine-5-carboxamide

Synonyms
compound 15 [PMID: 17201405]

Synonyms

compound 15 [PMID: 17201405]

Database Links
BindingDB Ligand	14055
CAS Registry No.	864082-47-3 (source: PubChem)
ChEMBL Ligand	CHEMBL375312
GtoPdb PubChem SID	328083458
PubChem CID	11373846
Search Google for chemical match using the InChIKey	OLIIUAHHAZEXEX-UHFFFAOYSA-N
Search Google for chemicals with the same backbone	OLIIUAHHAZEXEX
Search UniChem for chemical match using the InChIKey	OLIIUAHHAZEXEX-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone	OLIIUAHHAZEXEX

Comments
GSK429286A is a selective small molecule tool inhibitor of Rho kinase 1 (ROCK1) [1].

Comments

GSK429286A is a selective small molecule tool inhibitor of Rho kinase 1 (ROCK1) [1].