骨架化合物库

Scaffolds and Scaffold-based Compounds
产品编号 LF7500
  库化合物信息   Excel SDF

Life Chemicals offers its original stock collection of 140,000 novel small-molecule screening compounds based on 1,300 novel molecular scaffolds (including more than 500 premium ones) for medicinal chemistry and drug discovery screening projects.

骨架化合物库
规格 价格/RMB
100 μL * 10 mM (in DMSO) 待询
250 μL * 10 mM (in DMSO) 待询
1 mg 待询
咨询化合物库

Scaffold selection and prioritization are performed by means of organic and analytical chemistry approaches (reaction-oriented scaffold design) where chemical scaffolds are viewed as structural cores with several diversity points. Their chemical modifications result in a number of intermediates/building blocks, subsequent functionalization/decoration of which provide final compounds. Retrosynthetic rules can be applied to isolate synthetically relevant scaffolds from compound sets.

Key features of the scaffold database:

  1. Maximum structural diversity and rare chemotypes selection
  2. The novelty for all scaffolds and potentially promising compounds verified with patent search (privileged IP position) and similarity to molecules included in the eMolecules database
  3. The number of variation points kept within 2-3 per scaffold, preference given to structures with one variation point per cycle
  4. Several structural physicochemical filters were applied (modified Lipinski and Veber rules, etc.)
  5. In-house MedChem structures filtering was also employed
    In order to improve the quality of final compounds, careful design, and strict selection of chemically diverse building blocks for scaffold decoration are performed with the reference to published criteria. Lead-oriented synthesis principles to enhance our HTS Compound Collection with high-quality drug-like screening compounds possessing optimal physicochemical properties are applied.

化合物库定制

我们的化合物库可以灵活定制! 了解更多

包装和存储

  • 干粉或者DMSO溶液置于带二维码的储存管中,或排列于96孔板/384孔板;
  • 蓝冰运输
获取筛选库化合物信息 (LF7500)
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