Synthesis, molecular modelling studies and ADME prediction of benzothiazole clubbed oxadiazole-Mannich bases, and evaluation of their anti-diabetic activity through in vivo model

2018 ◽  
Vol 77 ◽  
pp. 6-15 ◽  
Author(s):  
Rubina Bhutani ◽  
Dharam Pal Pathak ◽  
Garima Kapoor ◽  
Asif Husain ◽  
Ravi Kant ◽  
...  
Keyword(s):  
Molecular Modelling ◽  
Mannich Bases ◽  
In Vivo Model ◽  
Adme Prediction ◽  
Molecular Modelling Studies ◽  
Modelling Studies

Guanylthiourea derivatives as potential antimalarial agents: Synthesis, in vivo and molecular modelling studies

2017 ◽  
Vol 135 ◽  
pp. 339-348 ◽  
Author(s):  
Shweta Bhagat ◽  
Minhajul Arfeen ◽  
Legesse Adane ◽  
Savita Singh ◽  
Prati Pal Singh ◽  
...  
Keyword(s):  
Molecular Modelling ◽  
Antimalarial Agents ◽  
Molecular Modelling Studies ◽  
Modelling Studies

Recreational drugs 25I-NBOH and 25I-NBOMe bind to both Sudlow's sites I and II of Human Serum Albumin (HSA): Biophysical and molecular modeling studies

2021 ◽  
Author(s):  
Wellington Alves de Barros ◽  
Marina de Magalhães Silva ◽  
Maria Dayanne de Araújo Dantas ◽  
Josue Santos ◽  
Isis Figueiredo ◽  
...  
Keyword(s):  
Molecular Modeling ◽  
Human Serum Albumin ◽  
Serum Albumin ◽  
Human Serum ◽  
Molecular Modelling ◽  
Recreational Drugs ◽  
Modeling Studies ◽  
Molecular Modelling Studies ◽  
Modelling Studies ◽  
Molecular Modeling Studies

Experimental, biophysical, and molecular modelling studies between 25I-NBOH and 25I-NBOMe with human serum albumin (HSA) have indicated that these recreational drugs simultaneously bind to site I and II of the...

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