ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04936
Compound NameTrans-3-O-p-Hydroxycinnamoyl Ursolic Acid
Chemical ClassTerpenoids
Molecular Weight602.853
logP8.387
H-Bond Donor2.00
H-Bond Acceptor5
Caco-2 Permeability89.082
logSwat-10.148
Number of Primary Metabolites3
Polar Surface Area98.552
Rotatable Bonds6
logKhsa2.215
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids1
loghERG-4.097
Blood Brain Barrier (logBB)-1.442
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT01351
TaxKB   -
Structure Download

 






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