scholarly journals Conformational Analysis, Substituent Effect and Structure Activity Relationships of 16-Membered Macrodiolides

Author(s):  
Radhia Mazri ◽  
Salah Belaidi ◽  
Aicha Kerassa ◽  
Touhami Lanez

Electronic structures, Conformational Analysis, effect of the substitution and structure activity Relationships for macrodiolides, have been studied by PM3 and ab initio methods. In the present work, the calculated values, namely net charges, bond lengths, MESP, dipole moments, electron-affinities, heats of formation, drug-likeness and QSAR properties, are reported and discussed in terms of the biological activity of macrodiolides.

2020 ◽  
Vol 44 (6) ◽  
pp. 2247-2255
Author(s):  
Qifan Zhou ◽  
Lina Jia ◽  
Fangyu Du ◽  
Xiaoyu Dong ◽  
Wanyu Sun ◽  
...  

A novel series of pyrrole-3-carboxamides targeting EZH2 have been designed and synthesized. The structure–activity relationships were summarized by combining with in vitro biological activity assay and docking results.


2002 ◽  
Vol 14 (3) ◽  
pp. 143-181 ◽  
Author(s):  
Marco António Teixeira Zullo ◽  
Günter Adam

Brassinosteroids are a new class of plant hormones with a polyoxygenated steroid structure showing pronounced plant growth regulatory activity. This review covers their natural occurrence, biological and chromatographic methods for their detection, biosynthesis and metabolism, biological activity, structure-activity relationships and prospective agricultural uses.


1998 ◽  
Vol 33 (6) ◽  
pp. 501-508 ◽  
Author(s):  
Giovannella Strappaghetti ◽  
Stefano Corsano ◽  
Roberta Barbaro ◽  
Antonio Lucacchini ◽  
Gino Giannaccini ◽  
...  

ChemInform ◽  
2010 ◽  
Vol 30 (3) ◽  
pp. no-no
Author(s):  
G. STRAPPAGHETTI ◽  
S. CORSANO ◽  
R. BARBARO ◽  
A. LUCACCHINI ◽  
G. GIANNACCINI ◽  
...  

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