Substrate
/
Generation 1
XenoSite
Abacavir carboxylate
Nc1nc(NC2CC2)c2ncn(C3C=CC(C(=O)O)C3)c2n1
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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Nc1nc(N)c2ncn(C3C=CC(C(=O)O)C3)c2n1
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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.
nitrogen oxidation
Probability 0.10
0.10
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nitrogen oxidation
Probability 0.10
0.10
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nitrogen oxidation
Probability 0.09
0.09
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nitrogen oxidation
Probability 0.09
0.09
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dealkylation
Probability 0.06
0.06
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((sup 13)n)ammonia
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