XenoSite

Alectinib cation

CHEBI
Phase 1ReactivityEpoxidationQuinonationN-DealkylationUGT Conjugation
Alectinib cation Epoxidation prediction
CCc1cc2c(cc1N1CCC(N3CCOCC3)CC1)C(C)(C)c1[nH]c3c(c1C2=O)C1OC1C(C#N)=C3 Quinonation prediction
CC=C1C(=O)C2=C(C=C1N1CCC(N3CCOCC3)CC1)C(C)(C)c1[nH]c3c(c1C2=O)C1OC1C(C#N)=C3 stable oxygenation prediction
CC=C1C(=O)C2=C(C=C1N1CCC(N3CCOCC3)CC1)C(C)(C)c1[nH]c3c(c1C2=O)C1OC1C(C#N)=C3 unstable oxygenation prediction
CC=C1C(=O)C2=C(C=C1N1CCC(N3CCOCC3)CC1)C(C)(C)c1[nH]c3c(c1C2=O)C1OC1C(C#N)=C3 dehydrogenation prediction
CC=C1C(=O)C2=C(C=C1N1CCC(N3CCOCC3)CC1)C(C)(C)c1[nH]c3c(c1C2=O)C1OC1C(C#N)=C3 reduction prediction
CC=C1C(=O)C2=C(C=C1N1CCC(N3CCOCC3)CC1)C(C)(C)c1[nH]c3c(c1C2=O)C1OC1C(C#N)=C3 hydrolysis prediction
dehydration · 0.19
CC=C1CC2=C(C=C1N1CCC(N3CCOCC3)CC1)C(C)(C)c1[nH]c3c(c1C2=O)C1OC1C(C#N)=C3
Probability scale from 0.0 to 1.0