化学
李宾斯基五定律
苏林达克
对接(动物)
药理学
立体化学
生物活性
体外
组合化学
计算生物学
体内
生物信息学
生物化学
非甾体
护理部
生物技术
基因
生物
医学
作者
Nelilma Correia Romeiro,Ramon D.F. Leite,Lı́dia Moreira Lima,Suzana V.S. Cardozo,Ana Luísa P. Miranda,Carlos Alberto Manssour Fraga,Eliezer J. Barreiro
标识
DOI:10.1016/j.ejmech.2008.11.012
摘要
This paper describes the synthesis, pharmacological evaluation and docking studies of a series of new sulindac analogues. Overall, the designed compounds revealed good, in vivo, antinociceptive activity and satisfactory anti-inflammatory profile. Flexible molecular docking with COX-1/COX-2 has shown putative binding modes of the designed compounds while the theoretical evaluation of cell permeability based on Lipinski's rule of five has helped rationalize the biological results.
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