上海陶素生化科技有限公司
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产品名称： Fragmentlibraries Cas No.： 0000 规格:： 干粉，溶液 价格： 5000以上元/根据数量价 发布日期:： 2016-05-13 Fragmentlibraries
Fragment program at ChemDiv is aimed to address another approach in drug discovery – “fragment-based” drug design (FBDD). The immediately available fragment library includes 10,000+ structures. Those were selected from 1.2+ Mio collection and produced as the result of internal design & synthetic effort in consideration of the following guidelines:
• Widely accepted Astex Rule of Three[1] (MW ≤ 300, H-bond donors ≤ 3, H-bond acceptors ≤ 3, cLogP ≤ 3)
• The tagged fragments may contain only C, H, N, O, S, P, F, Cl, and Br atoms
• The tagged fragments must be chemically feasible for follow up linking and/or expansion
• The tagged fragments comply with internal medicinal chemistry filters (this way undesirable moieties, such as Michael acceptors, can be removed upfront)
• Add-ons of structures with fragment-“friendly” features, such as:
- NMR screening compatibility (chemical shifts of protons to be in the 0 – 12 range evenly; possession of both alkyl & aromatic protons, or “marker atoms”, e.g. F)
- X-ray screening compatibility (heavy atoms)
As with any other “classical” small molecules library, the data base with immediately available fragments can be provided (as MDL structure-data files (SDfiles) or ISIS Database (db) files) for follow up selection and ordering. The fragments can be dispensed in mg or micromolar amounts and delivered in a variety of formats (plates or vials, as dry powders or DMSO solutions).
Off-the-Shelf Fragment Library
Custom Fragment Generation
Expansion on Active Fragments
美国ChemDiv公司已经有20年的历史，目前在全球拥有超过1500名高端客户。占到全球市场份额的40%。公司致力于为药物发现，制药和生物技术发展的合作伙伴提供创新性解决方案；努力让工业和学术研究进行更好的融合，为威胁生命的疾病带来新的解决方法。公司拥有全球最大的小分子化合物库，除了目前库存的125万种化合物以外，每年以15万种新化合物的速度递增。陶素（topscience）作为美国chemdiv在中国的独家代理商，旨在为科研人员提供最专业的药物筛选服务和质量可靠的筛选化合物供应。
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