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Chemical structure of Nurr1 agonist 7

GC73722

Nurr1 agonist 7

Also known as 3-[(4-tert-butylphenyl)methoxy]benzoic acid

Nurr1 agonist 7 (compound 110) is a Nurr1 agonist with an EC50 value of 0·12 μM

ChemicalCAS228707-95-7MW284.35FormulaC18H20O3
CAS number
228707-95-7
Molecular weight
284.35
Formula
C18H20O3
Solubility
DMSO : ≥ 125 mg/mL (439·60 mM)
InChIKey
MJXOQKCMOQCDCH-UHFFFAOYSA-N
Catalogue number
GC73722
Brand
GLPBIO
Computed properties PubChem CID 18544100 · XLogP 4.6 · TPSA 46.5 Ų · H-bond donors 1
XLogP
4.6
TPSA
46.5 Ų
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
5
Heavy atoms
21

SMILES CC(C)(C)C1=CC=C(C=C1)COC2=CC=CC(=C2)C(=O)O

Computed descriptors from PubChem (CID 18544100), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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