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Chemical structure of MK2-IN-3

GC61819

MK2-IN-3

Also known as 2-(2-quinolin-3-yl-4-pyridinyl)-1,5,6,7-tetrahydropyrrolo[3,2-c]pyridin-4-one

MK2-IN-3 is a potent and selective inhibitor of MAPKAP-K2 (MK-2), with an IC50 of 8·5 nM

ChemicalCAS724711-21-1MW340.38FormulaC21H16N4O
CAS number
724711-21-1
Molecular weight
340.38
Formula
C21H16N4O
Solubility
DMSO ： 62·5 mg/mL (183·62 mM)
InChIKey
OWFLADWRSCINST-UHFFFAOYSA-N
Catalogue number
GC61819
Brand
GLPBIO
Computed properties PubChem CID 10389239 · XLogP 2.6 · TPSA 70.7 Ų · H-bond donors 2
XLogP
2.6
TPSA
70.7 Ų
H-bond donors
2
H-bond acceptors
3
Rotatable bonds
2
Heavy atoms
26

SMILES C1CNC(=O)C2=C1NC(=C2)C3=CC(=NC=C3)C4=CC5=CC=CC=C5N=C4

Computed descriptors from PubChem (CID 10389239), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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