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Chemical structure of TLX agonist 1

GC39261

TLX agonist 1

Also known as (4-benzhydrylpiperazin-1-yl)-(1,5-dimethylpyrazol-3-yl)methanone

TLX agonist 1 (ccrp2) is an orphan nuclear receptor tailless (TLX, NR2E1) modulator (EC50=1μM; Kd= 650 nM)

ChemicalCAS958323-31-4MW374.48FormulaC23H26N4O
CAS number
958323-31-4
Molecular weight
374.48
Formula
C23H26N4O
Solubility
DMSO： 62·5 mg/mL (166·90 mM)
InChIKey
SSGJAUSSGPIZEE-UHFFFAOYSA-N
Catalogue number
GC39261
Brand
GLPBIO
Computed properties PubChem CID 2738508 · XLogP 3.4 · TPSA 41.4 Ų · H-bond donors 0
XLogP
3.4
TPSA
41.4 Ų
H-bond donors
0
H-bond acceptors
3
Rotatable bonds
4
Heavy atoms
28

SMILES CC1=CC(=NN1C)C(=O)N2CCN(CC2)C(C3=CC=CC=C3)C4=CC=CC=C4

Computed descriptors from PubChem (CID 2738508), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

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