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Chemical structure of MLK-IN-1

GC64634

MLK-IN-1

Also known as N-(3,4-dimethoxyphenyl)-3-(7-methoxy-1-benzothiophen-2-yl)imidazo[1,2-b]pyridazin-6-amine

MLK-IN-1 is a potent, brain penetrant and specific mixed lineage kinase 3 (MLK-3) inhibitor, compound 68, extracted from patent US20140256733A1

ChemicalCAS1627729-62-7MW432.49FormulaC23H20N4O3S
CAS number
1627729-62-7
Molecular weight
432.49
Formula
C23H20N4O3S
Solubility
DMSO : 62·5 mg/mL (144·51 mM; ultrasonic and warming and heat to 80°C)
InChIKey
NTIXYCZKSHEEOH-UHFFFAOYSA-N
Catalogue number
GC64634
Brand
GLPBIO
Computed properties PubChem CID 90388209 · XLogP 4.8 · TPSA 98.2 Ų · H-bond donors 1
XLogP
4.8
TPSA
98.2 Ų
H-bond donors
1
H-bond acceptors
7
Rotatable bonds
6
Heavy atoms
31

SMILES COC1=C(C=C(C=C1)NC2=NN3C(=NC=C3C4=CC5=C(S4)C(=CC=C5)OC)C=C2)OC

Computed descriptors from PubChem (CID 90388209), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
Lot certificate of analysis and manufacturer SDS are emailed with your order confirmation.
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