Substrate
/
Generation 1
/
Generation 2
XenoSite
Monoacetyldapsone
CC(=O)Nc1ccc(S(=O)(=O)c2ccc(N)cc2)cc1
CHEBI
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Description
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 1
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N=C1C=CC(S(=O)(=O)c2ccc(N)cc2)=CC1=O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 2
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N=C1C=CC(S(=O)(=O)c2ccc(N)cc2)=CC1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 3
Select a metabolite to form the next generation.
epoxidation
Probability 0.33
0.33
epoxidation
Probability 0.06
0.06
epoxidation
Probability 0.03
0.03
epoxidation
Probability 0.01
0.01
epoxidation
Probability 0.01
0.01
Showing 5 of 6 metabolites
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