Huth Jeffrey R, Sun Chaohong
Global Pharmaceutical Research and Development, Abbott Park, IL 60064, USA.
Comb Chem High Throughput Screen. 2002 Dec;5(8):631-43. doi: 10.2174/1386207023329941.
NMR has proven to be a valuable tool for identifying small molecule drug leads that serve as starting points for lead optimization programs. In addition, NMR screening can also be applied during lead optimization in order to improve the pharmacokinetic properties of a compound. In this paper we review the NMR methods that can be used for this purpose. Several examples are then summarized to demonstrate the usefulness of fragment-based approaches in optimizing the physical properties of potential drug candidates.
核磁共振已被证明是一种用于识别小分子药物先导物的宝贵工具，这些先导物可作为先导物优化计划的起点。此外，核磁共振筛选也可应用于先导物优化过程中，以改善化合物的药代动力学性质。在本文中，我们综述了可用于此目的的核磁共振方法。然后总结了几个例子，以证明基于片段的方法在优化潜在药物候选物物理性质方面的有用性。
