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Product details

名称

MS049

分子类型

小分子

英文名称

MS049

货号

M650002-5mg

包装规格

5mg

级别

Moligand™

浓度

≥98%

储存温度

-20°C储存

运输条件

超低温冰袋运输

产品介绍

MS049 is a potent, selective, and cell-active dual inhibitor of PRMT4 and PRMT6 with IC 50 s of 34 nM and 43 nM, respectively. MS049 reduces levels of Med12me2a and H3R2me2a in HEK293 cells. MS049 is not toxic and does not affect the growth of HEK293 cells In Vitro MS049 (0.1-10 μM; 20 hours) reduces the H3R2me2a mark in HEK293 cells in a concentration dependent manner (IC 50 =0.97±0.05 μM). MS049 (0.1-100 μM; 72 hours) inhibits endogenous PRMT4 methyltransferase activity in a concentration dependent manner resulting in reduced levels of cellular asymmetric arginine dimethylation of Med12 (Med12-Rme2a, IC 50 =1.4±0.1 μM) in HEK293 cells. MS049 is selective for PRMT4 and PRMT6 over a broad range of epigenetic modifiers, including other PRMTs, PKMTs, DNMTs, KDMs, and methyllysine/methylarginine reader proteins, and non-epigenetic targets. MCE has not independently confirmed the accuracy of these methods. They are for reference only. Western Blot AnalysisCell Line: HEK293 cells Concentration: 0.1, 1, 10 μM Incubation Time: 20 hours Result: Reduced the H3R2me2a mark in HEK293 cells in a concentration dependent manner (IC 50 =0.97±0.05 μM). Western Blot AnalysisCell Line: HEK293 cells Concentration: 0.1, 1, 10, 100 μM Incubation Time: 72 hours Result: Reduced levels of cellular asymmetric arginine dimethylation of Med12 (Med12-Rme2a, IC 50 =1.4±0.1 μM) in HEK293 cells. Form:Solid IC50& Target:PRMT4 34 nM () PRMT6 43 nM () PRMT8 1600 nM ()

生化机理

MS049 是 PRMT4 和 PRMT6 的强效、选择性和细胞活性双重抑制剂，其 IC 50 s 分别为 34 nM 和 43 nM。MS049 可降低 HEK293 细胞中 Med12me2a 和 H3R2me2a 的水平。MS049 没有毒性，也不影响 HEK293 细胞的生长。

CAS号

1502816-23-0

分子式

C15H24N2O

分子量

248.36 g/mol

PubChem编号

53868701

Isomeric SMILES

CNCCN1CCC(CC1)OCC2=CC=CC=C2

IIUPAC Name

N-methyl-2-(4-phenylmethoxypiperidin-1-yl)ethanamine

INCHI

1S/C15H24N2O/c1-16-9-12-17-10-7-15(8-11-17)18-13-14-5-3-2-4-6-14/h2-6,15-16H,7-13H2,1H3

InChi Key

HBOJWAYLSJLULG-UHFFFAOYSA-N

Smiles

CNCCN1CCC(CC1)OCC2=CC=CC=C2

溶解性

H2O : ≥ 100 mg/mL (402.64 mM) DMSO : ≥ 31 mg/mL (124.82 mM)

氢键供体数Hydrogen Bond Donor Count

氢键受体数Hydrogen Bond Acceptor Count

可旋转键计数Rotatable Bond Count

精确质量Exact Mass

248.189 Da

单同位素质量Monoisotopic Mass

248.189 Da

拓扑极表面积Topological Polar Surface Area

24.500 Å²

重原子数Heavy Atom Count

形式电荷Formal Charge

复杂度Complexity

209.000

同位素原子数Isotope Atom Count

共价键合单元计数Covalently-Bonded Unit Count

XLogP3

1.700

Reaxy-Rn

30181165

Safety

「No Dangerous Attributes」

「No upstream and downstream information yet」

Technical Documents

「No technical documents」

Articles

「No related articles yet」

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