Substrate
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Generation 1
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Generation 2
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
About this model
Generation 1
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Nc1nc(NC2CC2)c2ncn(C3CC(C(=O)O)C4OC43)c2n1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
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NC1=NC(=NC2CC2)C2=NC(=O)N(C3CC(C(=O)O)C4OC43)C2=N1
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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.
dealkylation
Probability 0.91
0.91
dealkylation
Probability 0.91
0.91
dealkylation
Probability 0.91
0.91
Hydroxycyclopropane
dealkylation
Probability 0.30
0.30
dealkylation
Probability 0.30
0.30
Showing 5 of 13 metabolites
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