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Chemical structure of Reldesemtiv

GC61239

Reldesemtiv

Also known as 1-[2-[[3-fluoro-1-(3-fluoro-2-pyridinyl)cyclobutyl]methylamino]pyrimidin-5-yl]pyrrole-3-carboxamide

Reldesemtiv (CK-2127107) is a selective, orally active and next-generation fast skeletal muscle troponin activator (FSTA)

ChemicalCAS1345410-31-2MW384.38FormulaC19H18F2N6O
CAS number
1345410-31-2
Molecular weight
384.38
Formula
C19H18F2N6O
Solubility
DMSO ： 250 mg/mL (650·40 mM; Need ultrasonic)
InChIKey
MQXWPWOCXGARRK-UHFFFAOYSA-N
Catalogue number
GC61239
Brand
GLPBIO
Computed properties PubChem CID 67454400 · XLogP 1.5 · TPSA 98.7 Ų · H-bond donors 2
XLogP
1.5
TPSA
98.7 Ų
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
28

SMILES C1C(CC1(CNC2=NC=C(C=N2)N3C=CC(=C3)C(=O)N)C4=C(C=CC=N4)F)F

Computed descriptors from PubChem (CID 67454400), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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Documents
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