ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00755
Compound Name3-oxo-11alpha,12alpha-epoxy-olean-28,13beta-olide
Chemical ClassTerpenoids
Molecular Weight468.675
logP4.346
H-Bond Donor0.00
H-Bond Acceptor7
Caco-2 Permeability1796.281
logSwat-5.507
Number of Primary Metabolites1
Polar Surface Area67.512
Rotatable Bonds0
logKhsa0.751
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.527
Blood Brain Barrier (logBB)-0.115
CNS Permeability0
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2425
NPACT   -
TaxKB   -
Structure Download

 






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