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Asinex Macrocycles Library

MCE 國際站：Asinex Macrocycles Library

ASINEX has elaborated a library of diverse macrocycles using an effective tool box of synthetic methods. The resulting scaffolds are novel, tremendously diverse, medchem-relevant, macrocyclic frameworks.Macrocyles tend to be larger than traditional screening molecules which make them perfect discovery tools for targets with shallow or extended binding sites. At the same time, their unique character based on restricted flexibility and ability to form intra-molecular hydrogen bonds allows for design approaches effectively optimizing properties such asaqueous solubility and membrane permeability. Many of these macrocycles have been tested for aqueous and DMSO solubility with cut-offs applied at 10 mM in DMSO and 50 μM in PBS (pH 7.4) followed by PAMPA permeability assay.

Description & Advantages:

????Unparalleled diversity which covers both peptide-like and non-peptidicchemotypes.

????Comprised of 200+ scaffolds, making this library the largest commercial screening collection of scaffold-based macrocycles.

????A perfect discovery tools for targets with shallow or extended binding sites.

????More than 4000 of macrocycles have been tested for aqueous solubility and PAMPA permeability. This valuable dataset was used to build up an ML-based computational model to predict the permeability of novel macrocycles based on their 2D and 3D descriptors.

????All compounds can be readily followed with analogues either from stock or from new syntheses.

????Databases and compounds are provided by Asinex.

品牌介紹:
????MCE (MedChemExpress) 擁有200 多種全球獨家化合物庫，我們致力于為全球科研客戶提供前沿最全的高品質小分子活性化合物；
????50,000 多種高選擇性抑制劑、激動劑涉及各熱門信號通路及疾病領域；
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????Nature, Cell, Science 等多種頂級期刊及制藥專利收錄了MCE客戶的科研成果；
????專業團隊跟蹤最新的制藥及生命科學研究進展，為您提供全球最新的活性化合物；
????與世界各大制藥公司及知名科研機構建立了長期的合作。