Search compounds with antimicrobial activity by applying molecular topology to selected quinolones.
Molecular topology was used to obtain substances with antimicrobial activity. Selected quinolones were employed to develop the corresponding connectivity functions and discriminant equation. Limiting functions were selected that allowed the discriminant function to more efficiently distinguish substances with and without antibacterial activity. Antibacterial tests were run to confirm the theoretically established activity.
Mut-Ronda
S
S
Unidad de Investigación de Diseño de Fármacos y Conectividad Molecular, Departamento de Química Física, Universidad de Valencia, Valencia, Spain.
Salabert-Salvador
M T
MT
Duart
M J
MJ
Antón-Fos
G M
GM
D000818:Animals; D000900:Anti-Bacterial Agents / Q000138:chemical synthesis* / Q000494:pharmacology; D001419:Bacteria / Q000187:drug effects; D016002:Discriminant Analysis; D015195:Drug Design; D008826:Microbial Sensitivity Tests; D021281:Quantitative Structure-Activity Relationship; D015363:Quinolones / Q000138:chemical synthesis* / Q000494:pharmacology
D000900:Anti-Bacterial Agents; D015363:Quinolones