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Chemical structure of MGL-3196

GC18243

MGL-3196

Also known as 2-[3,5-dichloro-4-[(6-oxo-5-propan-2-yl-1H-pyridazin-3-yl)oxy]phenyl]-3,5-dioxo-1,2,4-triazine-6-carbonitrile

MGL-3196 (MGL-3196) is a highly selective thyroid hormone receptor β (THR-β) agonist with an EC50 value of 0·21 μM

ChemicalCAS920509-32-6MW435.2FormulaC17H12Cl2N6O4
CAS number
920509-32-6
Molecular weight
435.2
Formula
C17H12Cl2N6O4
Solubility
DMF： 20 mg/ml,DMSO： 20 mg/ml,Ethanol： 1 mg/ml
InChIKey
FDBYIYFVSAHJLY-UHFFFAOYSA-N
Catalogue number
GC18243
Brand
GLPBIO
Computed properties PubChem CID 15981237 · XLogP 2.7 · TPSA 136 Ų · H-bond donors 2
XLogP
2.7
TPSA
136 Ų
H-bond donors
2
H-bond acceptors
7
Rotatable bonds
4
Heavy atoms
29

SMILES CC(C)C1=CC(=NNC1=O)OC2=C(C=C(C=C2Cl)N3C(=O)NC(=O)C(=N3)C#N)Cl

Computed descriptors from PubChem (CID 15981237), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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