Discovery, Structure-Activity Relationship Studies, and Crystal Structure of Nonpeptide Inhibitors Bound to the Shank3 PDZ Domain

ChemMedChem ◽  
2011 ◽  
Vol 6 (8) ◽  
pp. 1411-1422 ◽  
Author(s):  
Jörn Saupe ◽  
Yvette Roske ◽  
Christian Schillinger ◽  
Nestor Kamdem ◽  
Silke Radetzki ◽  
...  
Keyword(s):  
Crystal Structure ◽  
Pdz Domain ◽  
Structure Activity Relationship ◽  
Activity Relationship ◽  
Structure Activity

Two Cu(ii) complexes of triadimefon: crystal structure, antifungal activities and structure–activity relationship

2015 ◽  
Vol 39 (9) ◽  
pp. 6997-7003 ◽  
Author(s):  
Jie Li ◽  
Teng Xi ◽  
Biao Yan ◽  
Mingyan Yang ◽  
Jirong Song ◽  
...  
Keyword(s):  
Crystal Structure ◽  
Dft Calculations ◽  
Electronic Structures ◽  
Structure Activity Relationship ◽  
Activity Relationship ◽  
Antifungal Activities ◽  
Structure Activity ◽  
Theoretical Investigations ◽  
Biocidal Properties

Theoretical investigations of the electronic structures of Cu(ii) complexes carried out by DFT calculations partially explained the increased biocidal properties.

The Structure Activity Relationship and Cytotoxicity between Stemonal and 6-Deoxyclitoriacetal

2013 ◽  
Vol 699 ◽  
pp. 698-702
Author(s):  
Nattapong Pangkam ◽  
Thitiphan Chimsook
Keyword(s):  
Crystal Structure ◽  
Cell Lines ◽  
Cancer Cell ◽  
Cancer Cell Lines ◽  
Structure Activity Relationship ◽  
Activity Relationship ◽  
Cytotoxic Activities ◽  
Planar Structures ◽  
Structure Activity

Stemonal and 6-deoxyclitoriacetal, rotenoid compounds were isolated from the dried roots of Stemona collinsae Craib. Stemonal was recrystallized with methanol. Crystal structure of stemonal displayed only the planar structures while that of 6-deoxyclitoriacetal showed both the planar and bent shape structures. Stemonal and 6-deoxyclitoriacetal were tested their cytotoxic activities against three cancer cell lines and found that only 6-deoxyclitoriacetal has been showed the cytotoxicity.

scholarly journals Epimerization of glucose over ionic liquid/phosphomolybdate hybrids: structure–activity relationship

2018 ◽  
Vol 20 (5) ◽  
pp. 1042-1049 ◽  
Author(s):  
Cristina Megías-Sayago ◽  
Eleuterio Álvarez ◽  
Svetlana Ivanova ◽  
José Antonio Odriozola
Keyword(s):  
Crystal Structure ◽  
Ionic Liquid ◽  
Catalytic Activity ◽  
Chemical Nature ◽  
Structure Activity Relationship ◽  
Activity Relationship ◽  
Structure Activity

The influence of the crystal structure and chemical nature of some ionic liquid/phosphomolybdate hybrids on their catalytic activity in the epimerization of glucose was studied.

Structure-activity relationship of (-) mammea A/BB derivatives against Leishmania amazonensis

Planta Medica ◽  
2008 ◽  
Vol 74 (09) ◽  
Author(s):  
MA Brenzan ◽  
CV Nakamura ◽  
BPD Filho ◽  
T Ueda-Nakamura ◽  
MCM Young ◽  
...  
Keyword(s):  
Structure Activity Relationship ◽  
Leishmania Amazonensis ◽  
Activity Relationship ◽  
Structure Activity ◽  
Relationship Of
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