Substrate
/
Generation 1
/
Generation 2
/
Generation 3
XenoSite
Monoacetyldapsone
CC(=O)Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
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
CC(=O)Nc1ccc(S(=O)(=O)C2=CCC(=N)C=C2)cc1
Copy JSON
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
N=C1C=CC(S(=O)(=O)c2ccc(O)cc2)=CC1
Copy JSON
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 3
Show metabolites
N=C1C=CC(S(=O)(=O)C2=CC(=O)C(=O)C=C2)=CC1
Copy JSON
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
gsh
protein
cyanide
dna
Generation 4
Select a metabolite to form the next generation.
dna
Probability 0.44
0.44
protein
Probability 0.30
0.30
dna
Probability 0.19
0.19
protein
Probability 0.14
0.14
glutathionation
Probability 0.13
0.13
Showing 5 of 8 metabolites
Show all