Substrate
/
Generation 1
/
Generation 2
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
Generation 1
Show metabolites
COC(=O)CSc1cc(N=c2sc(=O)[nH]n2CCCC(=O)O)c(F)cc1Cl
Copy JSON
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
COC(=O)CSC1=C(Cl)C(=O)C(F)=C(N=c2sc(=O)[nH]n2CCCC(=O)O)C1=O
Copy JSON
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
gsh
protein
cyanide
dna
Generation 3
Select a metabolite to form the next generation.
glutathionation
Probability 0.85
0.85
protein
Probability 0.77
0.77
protein
Probability 0.39
0.39
glutathionation
Probability 0.21
0.21
dna
Probability 0.21
0.21
Showing 5 of 8 metabolites
Show all