ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00228
Compound Nametaiwaniaquinol A
Chemical ClassTerpenoids
Molecular Weight344.450
logP3.915
H-Bond Donor1.00
H-Bond Acceptor4
Caco-2 Permeability2630.492
logSwat-4.934
Number of Primary Metabolites3
Polar Surface Area62.045
Rotatable Bonds3
logKhsa0.632
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.667
Blood Brain Barrier (logBB)-0.151
CNS Permeability0
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol0549
NPACT   -
TaxKB   -
Structure Download

 






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