Substrate
/
Generation 1
XenoSite
Amrinone
Nc1cc(-c2ccncc2)c[nH]c1=O
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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NC1=CC2(c3ccncc3)OC2NC1=O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
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stable oxygenation
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unstable oxygenation
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dehydrogenation
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reduction
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hydrolysis
Generation 2
Select a metabolite to form the next generation.
dehydration
Probability 0.15
0.15
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dehydration
Probability 0.15
0.15
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15o
hydrogenation
Probability 0.15
0.15
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oxygen reduction
Probability 0.15
0.15
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nitrogen oxidation
Probability 0.14
0.14
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Showing 5 of 52 metabolites
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