CJ-42794结构式
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常用名 | CJ-42794 | 英文名 | CJ-42794 |
|---|---|---|---|---|
| CAS号 | 847728-01-2 | 分子量 | 413.826 | |
| 密度 | 1.3±0.1 g/cm3 | 沸点 | 572.7±50.0 °C at 760 mmHg | |
| 分子式 | C22H17ClFNO4 | 熔点 | N/A | |
| MSDS | N/A | 闪点 | 300.2±30.1 °C |
CJ-42794用途CJ-42794是一种选择性前列腺素受体EP4拮抗剂, 抑制[3H]-PGE2与EP4受体结合, 平均pKi为8.5, 选择性比EP1, EP2和EP3高200多倍。 |
| 中文名 | 4-[(1S)-1-[[5-氯-2-(4-氟苯氧基)苄基]氨基]乙基]苯甲酸 |
|---|---|
| 英文名 | 4-[(1S)-1-[[5-chloro-2-(4-fluorophenoxy)benzoyl]amino]ethyl]benzoic acid |
| 英文别名 | 更多 |
| 描述 | CJ-42794是一种选择性前列腺素受体EP4拮抗剂, 抑制[3H]-PGE2与EP4受体结合, 平均pKi为8.5, 选择性比EP1, EP2和EP3高200多倍。 |
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| 相关类别 | |
| 参考文献 |
| 密度 | 1.3±0.1 g/cm3 |
|---|---|
| 沸点 | 572.7±50.0 °C at 760 mmHg |
| 分子式 | C22H17ClFNO4 |
| 分子量 | 413.826 |
| 闪点 | 300.2±30.1 °C |
| 精确质量 | 413.083008 |
| PSA | 75.63000 |
| LogP | 5.91 |
| InChIKey | MWBNCZHVEXULBD-ZDUSSCGKSA-N |
| SMILES | CC(NC(=O)c1cc(Cl)ccc1Oc1ccc(F)cc1)c1ccc(C(=O)O)cc1 |
| 蒸汽压 | 0.0±1.7 mmHg at 25°C |
| 折射率 | 1.616 |
| 储存条件 | 2-8℃ |
| 海关编码 | 2924299090 |
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| 海关编码 | 2924299090 |
|---|---|
| 中文概述 | 2924299090. 其他环酰胺(包括环氨基甲酸酯)(包括其衍生物以及他们的盐). 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:30.0% |
| 申报要素 | 品名, 成分含量, 用途, 包装 |
| Summary | 2924299090. other cyclic amides (including cyclic carbamates) and their derivatives; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0% |
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实验名称:Thermal Shift Assay. Domain: start/stop: N44-E168
来源:ChEMBL
靶标:Bromodomain-containing protein 4
External Id:CHEMBL5060944
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实验名称:Antagonist activity at human EP4 receptor expressed in HEK293 cells assessed as inhib...
来源:ChEMBL
靶标:Prostaglandin E2 receptor EP4 subtype
External Id:CHEMBL1913310
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实验名称:Thermal Shift Assay. Domain start/stop: M626-G740
来源:ChEMBL
靶标:Peregrin
External Id:CHEMBL4650107
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实验名称:Thermal Shift Assay. Domain: start/stop: M1-L298
来源:ChEMBL
靶标:Cyclin-dependent kinase 2
External Id:CHEMBL5062802
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实验名称:Displacement of [3H]-PGE2 from human EP2 receptor expressed in HEK293 cells
来源:ChEMBL
靶标:Prostaglandin E2 receptor EP2 subtype
External Id:CHEMBL1913309
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实验名称:Displacement of [3H]-PGE2 from human EP4 receptor expressed in HEK293 cells
来源:ChEMBL
靶标:Prostaglandin E2 receptor EP4 subtype
External Id:CHEMBL1913308
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实验名称:Analgesic activity in po dosed rat assessed as inhibition of carrageenan-induced mech...
来源:ChEMBL
靶标:Rattus norvegicus
External Id:CHEMBL3997118
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实验名称:Analgesic activity against complete Freund's adjuvant-induced Sprague-Dawley rat infl...
来源:ChEMBL
靶标:Rattus norvegicus
External Id:CHEMBL1074447
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实验名称:Thermal Shift Assay. Domain: start/stop: E122-S403
来源:ChEMBL
靶标:Aurora kinase A
External Id:CHEMBL5067447
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实验名称:Thermal Shift Assay. Domain: start/stop: M1-K294
来源:ChEMBL
靶标:Casein kinase I isoform delta
External Id:CHEMBL5063731
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| (S)-4-(1-(5-chloro-2-(4-fluorophenoxy)benzamido)ethyl)benzoic acid |
| 4-[(1S)-1-{[5-Chloro-2-(4-fluorophenoxy)benzoyl]amino}ethyl]benzoic acid |
| CJ-42794 |