ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03333
Compound Name6beta,14alpha-dihydroxy-1alpha,7beta-diacetoxy-7alpha,20-epoxy-ent-kaur-16-en-15-one
Chemical ClassTerpenoids
Molecular Weight448.512
logP2.125
H-Bond Donor2.00
H-Bond Acceptor10
Caco-2 Permeability443.582
logSwat-4.014
Number of Primary Metabolites3
Polar Surface Area130.558
Rotatable Bonds5
logKhsa-0.019
Number of Reactive Functional Groups3
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.927
Blood Brain Barrier (logBB)-1.018
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2520
NPACT   -
TaxKB   -
Structure Download

 






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