S-[(5-pyridin-3-ylfuran-2-yl)methyl] ethanethioate

• 常用名: S-[(5-pyridin-3-ylfuran-2-yl)methyl] ethanethioate
• 英文名: S-[(5-pyridin-3-ylfuran-2-yl)methyl] ethanethioate
• CAS号: 859239-18-2
• 分子量: 233.28600
• 密度: N/A
• 沸点: N/A
• 分子式: C₁₂H₁₁NO₂S
• 熔点: N/A
• 闪点: N/A

名称

• 英文名: S-[(5-pyridin-3-ylfuran-2-yl)methyl] ethanethioate

物理化学性质

• 分子式: C₁₂H₁₁NO₂S
• 分子量: 233.28600
• 精确质量: 233.05100
• PSA: 68.40000
• LogP: 3.12130
• InChIKey: RZXSREPAAUXUKM-UHFFFAOYSA-N
• SMILES: CC(=O)SCc1ccc(-c2cccnc2)o1

靶点实验

查看更多实验

实验名称：Inhibition of human CYP2E1 assessed as reduction in specific vivid-blue substrate O-d... 来源：ChEMBL 靶标：Cytochrome P450 2E1 External Id：CHEMBL4422410

实验名称：Selectivity for CYP2A6 over CYP3A4 来源：ChEMBL 靶标：N/A External Id：CHEMBL910622

实验名称：Inhibition of human CYP2B6 assessed as reduction in specific vivid-blue substrate O-d... 来源：ChEMBL 靶标：Cytochrome P450 2B6 External Id：CHEMBL4422411

实验名称：Selectivity for CYP2A6 over CYP2E1 来源：ChEMBL 靶标：N/A External Id：CHEMBL910623

实验名称：Inhibition of human CYP2C9 assessed as reduction in specific vivid-blue substrate O-d... 来源：ChEMBL 靶标：Cytochrome P450 2C9 External Id：CHEMBL4422412

实验名称：CYP2A6 Inhibition Assay from Article 10.1021/jm060519r: "Synthetic inhibitors of cyto... 来源：BindingDB 靶标：N/A External Id：BindingDB_1583_1

实验名称：Selectivity for CYP2A6 over CYP2B6 来源：ChEMBL 靶标：N/A External Id：CHEMBL910624

实验名称：Inhibition of human CYP2C19 assessed as reduction in specific vivid-blue substrate O-... 来源：ChEMBL 靶标：Cytochrome P450 2C19 External Id：CHEMBL4422413

实验名称：Selectivity for CYP2A6 over CYP2C9 来源：ChEMBL 靶标：N/A External Id：CHEMBL910625

实验名称：Inhibition of human CYP2D6 assessed as reduction in specific vivid-blue substrate O-d... 来源：ChEMBL 靶标：Cytochrome P450 2D6 External Id：CHEMBL4422414

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英文别名

• S-(5-(pyridin-3-yl)furan-2-yl)methyl ethanethioate
• Ethanethioic acid,S-[[5-(3-pyridinyl)-2-furanyl]methyl] ester
• nicotine 3-heteroaromatic analogue 13