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ML406

Name: ML406
Brand: TargetMol
SKU: T8694
Price: 29 USD
Availability: InStock
Rating: 5 (10 reviews)

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Catalog No. T8694Cas No. 774589-47-8

ML406 shows anti-tubercular activity via MtbbioA (DAPA synthase) enzyme inhibition(IC50 : 30 nM)

ML406

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Purity: 98.69%

Catalog No. T8694Cas No. 774589-47-8

ML406 shows anti-tubercular activity via MtbbioA (DAPA synthase) enzyme inhibition(IC50 : 30 nM)

Pack Size	Price	USA Warehouse	Global Warehouse
10 mg	$34	In Stock	In Stock
25 mg	$68	In Stock	In Stock
50 mg	$103	In Stock	In Stock
100 mg	$156	In Stock	In Stock
500 mg	$392	-	In Stock
1 mL x 10 mM (in DMSO)	$29	In Stock	In Stock

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In Stock Estimated shipping dateUSA Warehouse[1-2 days] Global Warehouse[5-7 days]

All TargetMol products are for research purposes only and cannot be used for human consumption. We do not provide products or services to individuals. Please comply with the intended use and do not use TargetMol products for any other purpose.

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Batch Information

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Purity:98.69%

Appearance:Solid

Color:White

Resource Download

COA HNMR LCMS

Product Introduction

ML406 AI Summary

ML406 demonstrates a range of bioactivities with significant potency in various assays. It inhibits the MLL CXXC domain-DNA interaction, ROR gamma transcriptional activity, the delayed death in malarial parasite plastid, and the Mycobacterium tuberculosis BioA enzyme. The compound also serves as an agonist for gsp—an etiologic mutation responsible for Fibrous Dysplasia/McCune-Albright Syndrome—and acts as an inhibitor of human tyrosyl-DNA phosphodiesterase 1, both in the presence and absence of CPT. Potency levels across these activities range from 49.7 nM to 50118.7 nM. Specific to Mycobacterium tuberculosis H37Rv, ML406 shows inhibition of Bio-A with MIC50 values between 400.0 nM and 5600.0 nM, and MIC90 values from 1700.0 nM to 23400.0 nM under different conditions. It also exhibits an IC50 value of 155.0 nM for wild-type Mycobacterium tuberculosis Bio-A using KAPA as a substrate, has an antibacterial activity with a MIC value of 26000.0 nM against Mycobacterium tuberculosis H37Rv, and displays binding affinity with a Kd value of 108.0 nM to N-terminally His-tagged BioA overexpressed in Escherichia coli..

Note: Summary generated by AI. Data source: ChEMBL

Bioactivity

Description	ML406 shows anti-tubercular activity via MtbbioA (DAPA synthase) enzyme inhibition(IC50 : 30 nM)
Targets&IC50	BioA:IC50 : 30 nM

Chemical Properties

Molecular Weight	352.38
Formula	C₂₀H₂₀N₂O₄
Cas No.	774589-47-8
Smiles	CC(=O)c1ccc(cc1)N1CCN(CC1)C(=O)c1ccc2OCOc2c1
Relative Density.	1.293 g/cm3 (Predicted)

Storage & Solubility Information

Storage

Powder: -20°C for 3 years | In solvent: -80°C for 1 year | Shipping with blue ice/Shipping at ambient temperature.

Solubility Information

DMSO: 100 mg/mL (283.78 mM), Sonication is recommended.

In Vivo Formulation

10% DMSO+40% PEG300+5% Tween 80+45% Saline: 4 mg/mL (11.35 mM), Sonication is recommended.

Please add the solvents sequentially, clarifying the solution as much as possible before adding the next one. Dissolve by heating and/or sonication if necessary. Working solution is recommended to be prepared and used immediately. The formulation provided above is for reference purposes only. In vivo formulations may vary and should be modified based on specific experimental conditions.

Solution Preparation Table

DMSO

	1mg	5mg	10mg	50mg
1 mM	2.8378 mL	14.1892 mL	28.3785 mL	141.8923 mL
5 mM	0.5676 mL	2.8378 mL	5.6757 mL	28.3785 mL
10 mM	0.2838 mL	1.4189 mL	2.8378 mL	14.1892 mL
20 mM	0.1419 mL	0.7095 mL	1.4189 mL	7.0946 mL
50 mM	0.0568 mL	0.2838 mL	0.5676 mL	2.8378 mL
100 mM	0.0284 mL	0.1419 mL	0.2838 mL	1.4189 mL

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In Vivo Formulation Calculator (Clear solution)

Please enter your animal experiment information in the following box and click Calculate to obtain the stock solution preparation method and in vivo formula preparation method:

For example, if the intended dosage is 10 mg/kg for animals weighing 20 g , with a dosing volume of 100 μL per animal, TargetMol | Animal experiments

and a total of 10 animals are to be administered, using a formulation of TargetMol | reagent

10% DMSO+ 40% PEG300+ 5% Tween 80+ 45% Saline/PBS/ddH₂O , the resulting working solution concentration would be 2 mg/mL.

Stock Solution Preparation:

Dissolve 2 mg of the compound in 100 μL DMSO TargetMol | reagent to obtain a stock solution at a concentration of 20 mg/mL . If the required concentration exceeds the compound's known solubility, please contact us for technical support before proceeding.

Preparation of the In Vivo Formulation:

1) Add 100 μL of the DMSO TargetMol | reagent stock solution to 400 μL PEG300 and mix thoroughly until the solution becomes clear.

2) Add 50 μL Tween 80 and mix well until fully clarified.

3) Add 450 μL Saline,PBS or ddH₂O TargetMol | reagent and mix thoroughly until a homogeneous solution is obtained.

This example is provided solely to demonstrate the use of the In Vivo Formulation Calculator and does not constitute a recommended formulation for any specific compound. Please select an appropriate dissolution and formulation strategy based on your experimental model and route of administration.

All co-solvents required for this protocol, includingDMSO, PEG300/PEG400, Tween 80, SBE-β-CD, and Corn oil, are available for purchase on the TargetMol website.

Dose Conversion

You can also refer to dose conversion for different animals. More Dose Conversion

Tech Support

Please see Inhibitor Handling Instructions for more frequently ask questions. Topics include: how to prepare stock solutions, how to store products, and cautions on cell-based assays & animal experiments, etc