ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02459
Compound Name3,3'-Dimethylquercetin
Chemical ClassFlavonoids
Molecular Weight330.293
logP2.019
H-Bond Donor2.00
H-Bond Acceptor5
Caco-2 Permeability158.676
logSwat-3.826
Number of Primary Metabolites5
Polar Surface Area111.601
Rotatable Bonds5
logKhsa0.036
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.012
Blood Brain Barrier (logBB)-1.502
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1220
NPACT   -
TaxKB   -
Structure Download

 






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