Substrate
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Generation 1
XenoSite
Brivanib alaninate
Cc1cc2c(F)c(Oc3ncnn4cc(OCC(C)OC(=O)C(C)N)c(C)c34)ccc2[nH]1
CHEBI
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Description
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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 1
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(2<i>r</i>)-2-(<small>d</small>-alanyloxy)propionic acid
CC(N)C(=O)OC(C)C(=O)O
CHEBI
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Description
▾
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.
hydrolysis
Probability 0.89
0.89
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Alanine
hydrolysis
Probability 0.89
0.89
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hydrolysis
Probability 0.89
0.89
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Lactic acid
dealkylation
Probability 0.10
0.10
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dealkylation
Probability 0.10
0.10
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Showing 5 of 57 metabolites
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