Nalidixic acid

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Nalidixic acid Quinonation prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CC1=NC2=NC=C(C(=O)O)C(=O)C2=CC1=O Epoxidation prediction

Generation 2

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CC1=NC2=NC3OC3(C(=O)O)C(=O)C2=CC1=O N-Dealkylation prediction

Generation 3

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CC1=NC(=N)C(C(=O)C2(C(=O)O)OC2=O)=CC1=O gsh prediction

CC1=NC(=N)C(C(=O)C2(C(=O)O)OC2=O)=CC1=O protein prediction

CC1=NC(=N)C(C(=O)C2(C(=O)O)OC2=O)=CC1=O cyanide prediction

CC1=NC(=N)C(C(=O)C2(C(=O)O)OC2=O)=CC1=O dna prediction

Generation 4

glutathionation · 0.19

*C(=O)C(O)(C(=O)O)C(=O)C1=CC(=O)C(C)=NC1=N |$GSH;;;;;;;;;;;;;;;;;;$|