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Chemical structure of TYK2-IN-2

GC31668

TYK2-IN-2

Also known as 6-(3,5-dimethylanilino)-8-(methylamino)imidazo[1,2-b]pyridazine-3-carboxamide

TyK2-IN-2 (Compoud 18) is a potent and selective TYK2 inhibitor with IC50s of 7 nM, 0·1 μM and 0·05 μM for TYK2 JH2, IL-23 and IFNα, respectively

ChemicalCAS2098466-94-3MW310.35FormulaC16H18N6O
CAS number
2098466-94-3
Molecular weight
310.35
Formula
C16H18N6O
Solubility
DMSO : ≥ 25 mg/mL (80·55 mM)
InChIKey
SNVFFECYFQEWTL-UHFFFAOYSA-N
Catalogue number
GC31668
Brand
GLPBIO
Computed properties PubChem CID 129626433 · XLogP 2.1 · TPSA 97.3 Ų · H-bond donors 3
XLogP
2.1
TPSA
97.3 Ų
H-bond donors
3
H-bond acceptors
5
Rotatable bonds
4
Heavy atoms
23

SMILES CC1=CC(=CC(=C1)NC2=NN3C(=CN=C3C(=C2)NC)C(=O)N)C

Computed descriptors from PubChem (CID 129626433), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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