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Chemical structure of Sevasemten

GC69881

Sevasemten

Also known as 2-[(5-fluoro-3-pyridinyl)methyl]-6-[2-(2,2,2-trifluoroethoxy)pyrimidin-5-yl]pyridazin-3-one

Sevasemten is a conformational inhibitor of skeletal muscle myosin· Sevasemten selectively inhibits myosin with IC50 values of ≤ 10 μM (skeletal) or >100 μM (cardiac)

ChemicalCAS2417395-15-2MW381.28FormulaC16H11F4N5O2
CAS number
2417395-15-2
Molecular weight
381.28
Formula
C16H11F4N5O2
Solubility
DMSO ： 250 mg/mL (655·69 mM; Need ultrasonic)
InChIKey
XFPJKQRXBAFXNK-UHFFFAOYSA-N
Catalogue number
GC69881
Brand
GLPBIO
Computed properties PubChem CID 149205919 · XLogP 1.7 · TPSA 80.6 Ų · H-bond donors 0
XLogP
1.7
TPSA
80.6 Ų
H-bond donors
0
H-bond acceptors
10
Rotatable bonds
5
Heavy atoms
27

SMILES C1=CC(=O)N(N=C1C2=CN=C(N=C2)OCC(F)(F)F)CC3=CC(=CN=C3)F

Computed descriptors from PubChem (CID 149205919), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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