2-{[5-cyano-4-(3-methoxyphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(4-sulfamoylphenyl)acetamide

• 常用名: 2-{[5-cyano-4-(3-methoxyphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(4-sulfamoylphenyl)acetamide
• 英文名: 2-{[5-cyano-4-(3-methoxyphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(4-sulfamoylphenyl)acetamide
• CAS号: 440109-20-6
• 分子量: 471.5
• 密度: N/A
• 沸点: N/A
• 分子式: C₂₀H₁₇N₅O₅S₂
• 熔点: N/A
• 闪点: N/A

名称

• 英文名: 2-{[5-cyano-4-(3-methoxyphenyl)-6-oxo-1,6-dihydropyrimidin-2-yl]sulfanyl}-N-(4-sulfamoylphenyl)acetamide

物理化学性质

• 分子式: C₂₀H₁₇N₅O₅S₂
• 分子量: 471.5
• InChIKey: MFBIUOFKXQKEGQ-UHFFFAOYSA-N
• SMILES: COc1cccc(-c2nc(SCC(=O)Nc3ccc(S(N)(=O)=O)cc3)[nH]c(=O)c2C#N)c1

靶点实验

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实验名称：Inhibition of human recombinant carboxy-terminal his-tagged LDHB (1 to 333) expressed... 来源：ChEMBL 靶标：L-lactate dehydrogenase B chain External Id：CHEMBL2384178

实验名称：Clearance in human liver microsomes at 1 uM up to 60 mins 来源：ChEMBL 靶标：Liver microsomes External Id：CHEMBL2384175

实验名称：Inhibition of human recombinant carboxy-terminal his-tagged LDHA (1 to 331) expressed... 来源：ChEMBL 靶标：L-lactate dehydrogenase A chain External Id：CHEMBL2384303

实验名称：Binding affinity to human recombinant carboxy-terminal avi-tagged LDHA (1 to 331) exp... 来源：ChEMBL 靶标：L-lactate dehydrogenase A chain External Id：CHEMBL2384180

实验名称：SARS-CoV 3CL Protease Inhibition Assay from Article 10.1021/jm050852f: "Discovery of ... 来源：BindingDB 靶标：N/A External Id：BindingDB_1399_1

实验名称：Aqueous solubility of the compound in PBS buffer at pH 7.2 at 100 uM after 24 hrs 来源：ChEMBL 靶标：N/A External Id：CHEMBL2384174

实验名称：Cell-based high throughput primary assay to identify activators of GPR151 来源：The Scripps Research Institute Molecular Screening Center 靶标：RecName: Full=G-protein coupled receptor 151; AltName: Full=G-protein coupled receptor PGR7; AltName: Full=GPCR-2037; AltName: Full=Galanin receptor 4; AltName: Full=Galanin-receptor-like protein; Short=GalRL External Id：GPR151_PHUNTER_AG_LUMI_1536_1X%ACT

实验名称：AlphaScreen-based biochemical high throughput primary assay to identify activators of... 来源：The Scripps Research Institute Molecular Screening Center 靶标：N/A External Id：FBW7_ACT_ALPHA_1536_1X%ACT PRUN

实验名称：AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of... 来源：The Scripps Research Institute Molecular Screening Center External Id：MITF_INH_Alpha_1536_1X%INH PRUN

实验名称：Inhibition of SARS coronavirus 3C-like protease 来源：ChEMBL 靶标：Replicase polyprotein 1a External Id：CHEMBL871248

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