MRS 1220 (CAS 183721-15-5)

物理状态 :

Solid

溶解度 :

Soluble in DMSO (100 mM with gentle warming). Insoluble in water, and ethanol.

保存 :

Store at room temperature

熔点 :

244-245° C

密度 :

~1.5 g/cm³ (Predicted)

折射率 :

n²⁰_D 1.74 (Predicted)

IC50 :

Adenosine A3-R: IC₅₀ = 7.2 nM (human); Reversed the effect of A3 agonist-elicited inhibition of tumor necrosis factor-alpha formation : IC₅₀ = 0.3 µM (human macrophage U-937 cell line); A3 receptors: IC₅₀ >1 µM (rat)

Ki 数据 :

Adenosine A3-R: K_i= 0.65 nM (human); Adenosine A2a receptor: K_i= 10.3 nM (rat); Adenosine A2A-R: K_i= 25 nM (human); Adenosine A1 receptor: K_i= 52.7 nM (rat)

pK值 :

pK_a: 8.18 (Predicted), pK_b: 0.64 (Predicted)

德国水公害等级 :

3

PubChem CID :

MDL 号码 :

MFCD01321046

SMILES :

C1=CC=C(C=C1)CC(=O)NC2=NC3=C(C=C(C=C3)Cl)C4=NC(=NN42)C5=CC=CO5