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Chemical structure of Bragsin2

GC64939

Bragsin2

Also known as 6-methoxy-5-nitro-2-(trifluoromethyl)chromen-4-one

Bragsin2 is a potent, selective and noncompetitive nucleotide exchange factor BRAG2 inhibitor, with an IC50 of 3 μM· Bragsin2 binds at the interface between the PH domain of BRAG2 and the lipid bilayer, leads BRAG2 unable to activate lipidated Arf GTPase· Bragsin2 affects breast cancer stem cells

ChemicalCAS342795-08-8MW289.16FormulaC11H6F3NO5
CAS number
342795-08-8
Molecular weight
289.16
Formula
C11H6F3NO5
Solubility
DMSO ： 100 mg/mL (345·83 mM; Need ultrasonic)
InChIKey
WJUILHMXVGFAIS-UHFFFAOYSA-N
Catalogue number
GC64939
Brand
GLPBIO
Computed properties PubChem CID 799794 · XLogP 2.2 · TPSA 81.4 Ų · H-bond donors 0
XLogP
2.2
TPSA
81.4 Ų
H-bond donors
0
H-bond acceptors
8
Rotatable bonds
1
Heavy atoms
20

SMILES COC1=C(C2=C(C=C1)OC(=CC2=O)C(F)(F)F)[N+](=O)[O-]

Computed descriptors from PubChem (CID 799794), public domain. Identity cross-checked against the supplier's molecular formula and weight — verify before use.

Ordering in Israel

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Documents
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