Synthesis and biological evaluation of 2-(3-((2-(2-(quinoline-4-yloxy)acetyl)-hydrazineylidene)methyl)-1h-indol-1-yl)acetamide derivatives as antiprotozoal agent: in silico molecular docking study

HIGHLIGHTS

• What: The synthesis and characterization of 2-(3-((2-(2-(quinolin4-yloxy)acetyl)hydrazineylidene)methyl)-1H-indol-1-yl)- TABLE-4 BINDING AFFINITY VALUES OF QUINOLINE-INDOLYLACETAMIDE DERIVATIVES (QC1-QC11) Compound Binding free_energy (kcal/mol) pKi Ligand efficiency (kcal/mol/non-H atom) QC1 QC2 QC3 QC4 QC5 QC6 QC7 QC8 QC9 QC10 QC11 Hydrogen bond Amino acid residues GLN 274, SER 275 GLN 171, ASN 202 PRO 273, ASP 291 GLY 39, TRP 135, THR 49 SER 88, ASN 38, ALA 253 ASP 264, GLY 274 ASP 264, GLY 274 SER 275, GLN 290 THR 271 . . .
  

   

  

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