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VU0238441

更新时间:2025-09-19 12:55:39

VU0238441结构式
VU0238441结构式
品牌特惠专场
常用名 VU0238441 英文名 VU0238441
CAS号 85511-68-8 分子量 339.69600
密度 N/A 沸点 N/A
分子式 C16H9ClF3NO2 熔点 N/A
MSDS N/A 闪点 N/A

 VU0238441用途


VU0238441是泛毒蕈碱型乙酰胆碱受体 (mAChR) 阳性变构调节剂 (PAM),对 M1,M2,M3,M5 和 M4 的 EC50 分别为 3.2 μM,2.8 μM,2.2 μM,2.1 μM 和 > 10 μM。

 VU0238441名称

中文名 7-氯-1-((4-(三氟甲基)苯基)甲基)吲哚-2,3-二酮
英文名 7-Chloro-1-[4-(trifluoromethyl)benzyl]-1H-indole-2,3-dione
英文别名 更多

 VU0238441生物活性

描述 VU0238441是泛毒蕈碱型乙酰胆碱受体 (mAChR) 阳性变构调节剂 (PAM),对 M1,M2,M3,M5 和 M4 的 EC50 分别为 3.2 μM,2.8 μM,2.2 μM,2.1 μM 和 > 10 μM。
相关类别
靶点实验

EC50: 3.2 μM (M1), 2.8 μM (M2), 2.2 μM (M3), 2.1 μM (M5) and >10 μM (M4)[1]

体外研究 VU0238441是VU0119498的类似物[2]。
参考文献

[1]. Thomas M Bridges, et al. Chemical lead optimization of a pan G(q) mAChR M(1), M(3), M(5) positive allosteric modulator (PAM) lead. Part I: Development of the first highly selective M(5) PAM. Bioorg Med Chem Lett. 2010 Jan 15;20(2):558-62.

[2]. Thomas M Bridges, et al. Discovery of the first highly M5-preferring muscarinic acetylcholine receptor ligand, an M5 positive allosteric modulator derived from a series of 5-trifluoromethoxy N-benzyl isatins. J Med Chem. 2009 Jun 11;52(11):3445-8.

 VU0238441物理化学性质

分子式 C16H9ClF3NO2
分子量 339.69600
精确质量 339.02700
PSA 37.38000
LogP 4.15330
InChIKey MIAQTWNDRFRVOQ-UHFFFAOYSA-N
SMILES O=C1C(=O)N(Cc2ccc(C(F)(F)F)cc2)c2c(Cl)cccc21
储存条件 室温, 密封, 干燥

 VU0238441安全信息

危害码 (欧洲) Xn

 VU0238441合成线路

~95%

VU0238441结构式

VU0238441

85511-68-8

文献:Bridges, Thomas M.; Marlo, Joy E.; Niswender, Colleen M.; Jones, Carrie K.; Jadhav, Satyawan B.; Gentry, Patrick R.; Plumley, Hyekyung C.; Weaver, C. David; Conn, P. Jeffrey; Lindsley, Craig W. Journal of Medicinal Chemistry, 2009 , vol. 52, # 11 p. 3445 - 3448

 VU0238441上下游产品

VU0238441上游产品  2

VU0238441下游产品  0

 VU0238441靶点实验

查看更多实验

实验名称:Agonist activity at human muscarinic M5 expressed in CHO cells assessed as stimulatio...
来源:ChEMBL
靶标:Muscarinic acetylcholine receptor M5
External Id:CHEMBL1071910
实验名称:Activation of rat muscarinic M1 receptor expressed in CHO cells co-expressing Gq prot...
来源:ChEMBL
靶标:Muscarinic acetylcholine receptor M1
External Id:CHEMBL939027
实验名称:Agonist activity at rat muscarinic M1 expressed in CHO cells assessed as stimulation ...
来源:ChEMBL
靶标:Muscarinic acetylcholine receptor M1
External Id:CHEMBL1071304
实验名称:Activation of human muscarinic M5 receptor expressed in CHO cells coexpressing Gq pro...
来源:ChEMBL
靶标:Muscarinic acetylcholine receptor M5
External Id:CHEMBL957802
实验名称:Activation of rat muscarinic M2 receptor expressed in CHO cells coexpressing chimeric...
来源:ChEMBL
靶标:Muscarinic acetylcholine receptor M2
External Id:CHEMBL955372
实验名称:Ratio of AUC in rat brain to AUC in rat plasma
来源:ChEMBL
靶标:N/A
External Id:CHEMBL1071914
实验名称:Activation of human muscarinic M3 receptor expressed in CHO cells coexpressing Gq pro...
来源:ChEMBL
靶标:Muscarinic acetylcholine receptor M3
External Id:CHEMBL957798
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 VU0238441英文别名

VU0238441
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