Substrate
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Generation 1
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Generation 2
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Generation 3
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
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Generation 1
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CC(=O)Nc1ccc(S(=O)(=O)c2ccc(O)cc2)cc1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
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Generation 2
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CC(=O)Nc1ccc(S(=O)(=O)C2=CC3OC3(O)C=C2)cc1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 3
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CC(=O)N=C1C=CC(S(=O)(=O)C2=CC3OC3(O)C=C2)=CC1=O
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quinone formation · 0.03
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation