Substrate
Generation 1
Generation 2

Bdsf

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

Bdsf stable oxygenation prediction

Bdsf unstable oxygenation prediction

Bdsf dehydrogenation prediction

Bdsf reduction prediction

Bdsf hydrolysis prediction

Generation 1

Phase 1 Reactivity Epoxidation Quinonation N-Dealkylation UGT Conjugation

CCC(=O)CCCCCCC=CC(=O)O gsh prediction

CCC(=O)CCCCCCC=CC(=O)O protein prediction

CCC(=O)CCCCCCC=CC(=O)O cyanide prediction

CCC(=O)CCCCCCC=CC(=O)O dna prediction

Generation 2

dna · 0.66

*C(C=C(O)O)CCCCCCC(=O)CC |$DNA;;;;;;;;;;;;;;;$|