Substrate
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Generation 1
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Generation 2
XenoSite
Barasertibum
CCN(CCCOc1ccc2c(Nc3cc(CC(=O)Nc4cccc(F)c4)[nH]n3)ncnc2c1)CCOP(=O)(O)O
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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CCN(CCCOc1ccc2c(Nc3cc(CC=O)[nH]n3)ncnc2c1)CCOP(=O)(O)O
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Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
Generation 2
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Phosphoglycolic acid
O=C(O)COP(=O)(O)O
CHEBI
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Description
▾
Phase 1
Reactivity
Epoxidation
Quinonation
N-Dealkylation
UGT Conjugation
i
About this model
stable oxygenation
unstable oxygenation
dehydrogenation
reduction
hydrolysis
Generation 3
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dephosphorylation
Probability 0.65
0.65
Glycolic acid
dephosphorylation
Probability 0.65
0.65
Phosphonic acid
dealkylation
Probability 0.06
0.06
Oxalic acid
dealkylation
Probability 0.06
0.06
Glycolic acid
dealkylation
Probability 0.06
0.06
Glyoxylic acid
Showing 5 of 27 metabolites
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