ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00683
Compound Name(20S)-11beta,14beta-dihydroxy-20-ethoxy-7alpha,20-epoxy-ent-kaur-16-en-15-one (13)
Chemical ClassTerpenoids
Molecular Weight376.492
logP2.094
H-Bond Donor2.00
H-Bond Acceptor9
Caco-2 Permeability1093.476
logSwat-3.339
Number of Primary Metabolites3
Polar Surface Area74.332
Rotatable Bonds5
logKhsa-0.108
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.498
Blood Brain Barrier (logBB)-0.593
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2196
NPACT   -
TaxKB   -
Structure Download

 






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