Synthesis, Characterization, and Antileishmanial Activity of Certain Quinoline-4-carboxylic Acids

Table 2

Docking energies (kcal/mol) of the synthesized compounds.

	PTR1	NMT	MapK	AS	DHODH
Q1	−6.3	−6.9	−6.6	−7.1	−6.9
Q2	−7.9	−8.5	−7.7	−8.3	−8.3
Q3	−8.0	−8.7	−8.0	−8.6	−9.0
Q4	−8.1	−8.0	−7.8	−7.7	−9.0
Q5	−7.6	−8.7	−8.0	−8.6	−8.6
Q6	−7.7	−7.9	−7.9	−7.8	−8.1
Q7	−8.0	−8.4	−8.0	−8.5	−8.9
Q8	−8.1	−8.3	−8.0	−8.0	−8.7
Q9	−6.8	−7.3	−7.3	−8.2	−8.1
Q10	−8.4	−9.3	−8.2	−7.9	−9.3
Q11	−8.2	−8.6	−8.2	−7.8	−9.6
Q12	−7.6	−8.5	−8.3	−7.8	−9.3
Q13	−8.3	−8.6	−8.3	−7.8	−9.6
Q14	−8.9	−8.9	−8.9	−9.6	−10.4
Q15	−9.0	−8.3	−9.3	−8.9	−8.3
FMN	—	—	—	—	−9.7

FMN = flavin mononucleotide.