Tirasemtiv
5-ethynyl-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one
Molecular Identity
Tirasemtiv
5-ethynyl-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-one
PubChem CID: 23729157
2D Structure
Properties
C12H14N4O
Molecular Formula
230.27
Molecular Weight
g/mol
230.1168
Exact Mass
Da
1.4
XLogP
Drug-like (Lipinski: < 5)
58.1
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
3
H-Bond Acceptors
344
Complexity
SMILES
Canonical SMILES
SMILES: CCC(CC)N1C2=NC(=CN=C2NC1=O)C#CIsomeric SMILES
SMILES: CCC(CC)N1C2=NC(=CN=C2NC1=O)C#CSynonyms(20)
Tirasemtiv1005491-05-3CK-2017357CK2017357G8WSM7R6356-Ethynyl-1-(pentan-3-yl)-2H-imidazo(4,5-b)pyrazin-2-oneDTXSID90143379tirasemtivumRefChem:898226DTXCID80658706-ethynyl-1-(pentan-3-yl)-1H,2H,3H-imidazo(4,5-b)pyrazin-2-one5-ethynyl-3-pentan-3-yl-1H-imidazo[4,5-b]pyrazin-2-oneTirasemtiv(CK-2017357)6-ethynyl-1-(pentan-3-yl)-1H-imidazo[4,5-b]pyrazin-2-oltiraseMtiv (CK-2017357)
Data from PubChem (NCBI)
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