ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04077
Compound Name3-oxo-friedelan-28-oic acid
Chemical ClassTerpenoids
Molecular Weight456.707
logP6.177
H-Bond Donor1.00
H-Bond Acceptor4
Caco-2 Permeability232.155
logSwat-7.381
Number of Primary Metabolites2
Polar Surface Area66.270
Rotatable Bonds1
logKhsa1.464
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids1
loghERG-1.920
Blood Brain Barrier (logBB)-0.470
CNS Permeability-1
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT00146
TaxKB   -
Structure Download

 






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