tirasemtiv

Ligand id: 8280

Name: tirasemtiv

Structure and Physico-chemical Properties

2D Structure
Calculated Physico-chemical Properties
Hydrogen bond acceptors 5
Hydrogen bond donors 1
Rotatable bonds 3
Topological polar surface area 58.12
Molecular weight 230.12
XLogP 1.68
No. Lipinski's rules broken 0

Molecular properties generated using the CDK

Classification
Compound class Synthetic organic
IUPAC Name
5-ethynyl-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one
International Nonproprietary Names
INN number INN
9555 tirasemtiv
Synonyms
CK-2017357
Database Links
CAS Registry No. 1005491-15-3
ChEMBL Ligand CHEMBL3039529
PubChem CID 23729157
Search Google for chemical match using the InChIKey RSQGZEAXODVTOL-UHFFFAOYSA-N
Search Google for chemicals with the same backbone RSQGZEAXODVTOL
Search PubMed clinical trials tirasemtiv
Search PubMed titles tirasemtiv
Search PubMed titles/abstracts tirasemtiv
Search UniChem for chemical match using the InChIKey RSQGZEAXODVTOL-UHFFFAOYSA-N
Search UniChem for chemicals with the same backbone RSQGZEAXODVTOL
Comments
Tirasemtiv acts as an activator of the fast skeletal muscle (type II) troponin complex [3]. The compound is being investigated as a potential treatment for diseases and conditions associated with aging, muscle weakness and wasting or neuromuscular dysfunction [3] (eg amyotrophic lateral sclerosis, myasthenia gravis and claudication [1]).