Substrate
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Generation 1
XenoSite
Nalidixic acid
CCn1cc(C(=O)O)c(=O)c2ccc(C)nc21
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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C=C1N=c2c(c(=O)c(C(=O)O)cn2CC)=CC1=O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 2
Select a metabolite to form the next generation.
dehydration
Probability 0.27
0.27
dehydration
Probability 0.27
0.27
15o
hydrogenation
Probability 0.27
0.27
oxygen reduction
Probability 0.27
0.27
epoxidation
Probability 0.07
0.07
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