Substrate
/
Generation 1
XenoSite
Action
COC(=O)CSc1cc(N=c2sc(=O)n3n2CCCC3)c(F)cc1Cl
CHEBI
Copy JSON
Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 1
Show metabolites
2-[[2-chloro-4-fluoro-5-[(tetrahydro-3-oxo-1<em>h</em>,3<em>h</em>-[1,3,4]thiadiazolo[3,4-<em>a</em>]pyridazin-1-ylidene)amino]phenyl]thio]acetic acid
O=C(O)CSc1cc(N=c2sc(=O)n3n2CCCC3)c(F)cc1Cl
CHEBI
Copy JSON
Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Select a metabolite to form the next generation.
glucuronidation
Probability 0.99
0.99