Substrate
/
Generation 1
/
Generation 2
/
Generation 3
XenoSite
Azabenzimidazole
c1cnc2nc[nH]c2c1
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
Show metabolites
N=C1N=CNC1=CC=CO
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
Show metabolites
N=C1N=CNC1=CC1OC1O
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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 3
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N=C1C(=CC2OC2O)NC2ON12
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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.
glutathionation
Probability 0.82
0.82
dna
Probability 0.73
0.73
protein
Probability 0.55
0.55
glutathionation
Probability 0.23
0.23
glutathionation
Probability 0.10
0.10
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