Substrate
/
Generation 1
/
Generation 2
XenoSite
Abacavir glucuronide
Nc1nc(NC2CC2)c2ncn(C3C=CC(COC4OC(C(=O)O)C(O)C(O)C4O)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)c2nc[nH]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=NC23NC=NC2(O3)C(NC2CC2)=N1
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
gsh
protein
cyanide
dna
Generation 3
Select a metabolite to form the next generation.
dna
Probability 0.30
0.30
glutathionation
Probability 0.18
0.18
protein
Probability 0.15
0.15
glutathionation
Probability 0.13
0.13
protein
Probability 0.09
0.09
Showing 5 of 8 metabolites
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