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Chemical structure of SIK-IN-1

GC75743

SIK-IN-1

Also known as 3-[3-[(1-aminocyclopentyl)methoxy]-4-cyano-5-methylsulfanylphenyl]-6-(methylamino)imidazo[1,2-a]pyridine-5-carbonitrile

SIK-IN-1 (Compound 53) is an inhibitor for salt-inducible kinase (SIK), which inhibits SKI1, SIK2 and SIK3 with IC50s of 0·1, 0·4 and 1·5 nM, respectively

ChemicalCAS3033846-29-3MW432.54FormulaC23H24N6OS
CAS number
3033846-29-3
Molecular weight
432.54
Formula
C23H24N6OS
Solubility
DMSO： 100 mg/mL (231·19 mM; Need ultrasonic)
InChIKey
AWLHPMOLJAWKDL-UHFFFAOYSA-N
Catalogue number
GC75743
Brand
GLPBIO
Computed properties PubChem CID 171102035 · XLogP 4.4 · TPSA 137 Ų · H-bond donors 2
XLogP
4.4
TPSA
137 Ų
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
31

SMILES CNC1=C(N2C(=NC=C2C3=CC(=C(C(=C3)SC)C#N)OCC4(CCCC4)N)C=C1)C#N

Computed descriptors from PubChem (CID 171102035), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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