ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00684
Compound Name(20S)-11beta,14beta-dihydroxy-20-methoxy-7alpha,20-epoxy-ent-kaur-16-en-15-one (12)
Chemical ClassTerpenoids
Molecular Weight362.465
logP1.737
H-Bond Donor2.00
H-Bond Acceptor9
Caco-2 Permeability1094.351
logSwat-3.094
Number of Primary Metabolites3
Polar Surface Area75.001
Rotatable Bonds4
logKhsa-0.194
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.342
Blood Brain Barrier (logBB)-0.514
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2197
NPACT   -
TaxKB   -
Structure Download

 






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