6-氨基-3,5-二氰基-4-苯基-2(1H)-吡啶硫酮结构式
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常用名 | 6-氨基-3,5-二氰基-4-苯基-2(1H)-吡啶硫酮 | 英文名 | 2-amino-4-phenyl-6-sulfanylidene-1H-pyridine-3,5-dicarbonitrile |
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| CAS号 | 119022-76-3 | 分子量 | 252.29400 | |
| 密度 | N/A | 沸点 | N/A | |
| 分子式 | C13H8N4S | 熔点 | N/A | |
| MSDS | N/A | 闪点 | N/A |
| 中文名 | 6-氨基-3,5-二氰基-4-苯基-2(1H)-吡啶硫酮 |
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| 英文名 | 2-amino-4-phenyl-6-sulfanylidene-1H-pyridine-3,5-dicarbonitrile |
| 英文别名 | 更多 |
| 分子式 | C13H8N4S |
|---|---|
| 分子量 | 252.29400 |
| 精确质量 | 252.04700 |
| PSA | 126.02000 |
| LogP | 2.29296 |
| InChIKey | KTPFGSXXUDJFFQ-UHFFFAOYSA-N |
| SMILES | N#Cc1c(N)[nH]c(=S)c(C#N)c1-c1ccccc1 |
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~71%
6-氨基-3,5-二氰基-4-... 119022-76-3 |
| 文献:Quintela, Jose Maria; Peinador, Carlos; Veiga, Mari Carmen; Botana, Luis M.; Alfonso, Amparo; Riguera, Ricardo European Journal of Medicinal Chemistry, 1998 , vol. 33, # 11 p. 887 - 897 |
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~%
6-氨基-3,5-二氰基-4-... 119022-76-3 |
| 文献:Beukers, Margot W.; Chang, Lisa C. W.; Von Frijtag Drabbe Kuenzel, Jacobien K.; Mulder-Krieger, Thea; Spanjersberg, Ronald F.; Brussee, Johannes; Ijzerman, Ad P. Journal of Medicinal Chemistry, 2004 , vol. 47, # 15 p. 3707 - 3709 |
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~%
6-氨基-3,5-二氰基-4-... 119022-76-3 |
| 文献:Atalla; Hussein; Badr Revue Roumaine de Chimie, 1998 , vol. 43, # 2 p. 163 - 170 |
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~61%
6-氨基-3,5-二氰基-4-... 119022-76-3 |
| 文献:Atalla; Hussein; Badr Monatshefte fur Chemie, 1997 , vol. 128, # 1 p. 29 - 35 |
| 6-氨基-3,5-二氰基-4-苯基-2(1H)-吡啶硫酮上游产品 3 | |
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| 6-氨基-3,5-二氰基-4-苯基-2(1H)-吡啶硫酮下游产品 0 | |
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实验名称:Primary cell-based high-throughput screening assay for identification of compounds th...
来源:Johns Hopkins Ion Channel Center
靶标:regulator of G-protein signaling 4 isoform 2 [Homo sapiens]
External Id:JHICC_RGS_Act_HTS
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实验名称:Luminescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:mu-type opioid receptor isoform MOR-1 [Homo sapiens]
External Id:OPRM1-OPRD1_AG_LUMI_1536_1X%ACT PRUN
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实验名称:QFRET-based biochemical primary high throughput screening assay to identify exosite i...
来源:The Scripps Research Institute Molecular Screening Center
靶标:disintegrin and metalloproteinase domain-containing protein 17 preproprotein [Homo sapiens]
External Id:ADAM17_INH_QFRET_1536_1X%INH PRUN
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实验名称:Fluorescence-based cell-based primary high throughput screening assay to identify ago...
来源:The Scripps Research Institute Molecular Screening Center
靶标:muscarinic acetylcholine receptor M1 [Homo sapiens]
External Id:CHRM1_AG_FLUO8_1536_1X%ACT PRUN
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实验名称:uHTS identification of small molecule activators of the adaptive arm of the Unfolded ...
来源:Burnham Center for Chemical Genomics
靶标:N/A
External Id:BCCG-A405-UPR-XBP1-PrimaryAgonist-Assay
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实验名称:Antibacterial activity against Staphylococcus aureus MRSA ATCC 43300 (CO-ADD:GP_020);...
来源:ChEMBL
靶标:Staphylococcus aureus
External Id:CHEMBL4296184
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实验名称:Antibacterial activity against Klebsiella pneumoniae MDR ATCC 70063 (CO-ADD:GN_003); ...
来源:ChEMBL
靶标:Klebsiella pneumoniae
External Id:CHEMBL4296186
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实验名称:Antibacterial activity against Escherichia coli ATCC 25922 (CO-ADD:GN_001); MIC in CA...
来源:ChEMBL
靶标:Escherichia coli
External Id:CHEMBL4296185
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实验名称:High throughput fluorescence intensity-based biochemical assay to screen for small mo...
来源:University of Pittsburgh Molecular Library Screening Center
靶标:furin (paired basic amino acid cleaving enzyme), isoform CRA_a [Homo sapiens]
External Id:MH080376 Biochemical HTS for Inhibitors of the Proprotein Convertase Furin.
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实验名称:Fluorescence polarization to screen for inhibitor that competite the binding of FadD2...
来源:Broad Institute
靶标:FATTY-ACID-CoA LIGASE FADD28 (FATTY-ACID-CoA SYNTHETASE)
External Id:2147-01_Inhibitor_SinglePoint_HTS_Activity
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| 2-amino-4-phenyl-6-mercaptopyridine-3,5-dicarbonitrile |
| 2-amino-6-mercapto-4-phenylpyridine-3,5-dicarbonitrile |
| 2-amino-4-phenyl-6-sulfanylpyridine-3,5-dicarbonitrile |
| 3,5-Pyridinedicarbonitrile,6-amino-1,2-dihydro-4-phenyl-2-thioxo |
| 2-amino-3,5-dicyano-4-phenyl-6-mercaptopyridine |
| 2-amino-4-phenyl-6-sulphanylpyridine-3,5-dicarbonitrile |