ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04581
Compound NameOleanolic acid 3-O-alpha-L-rhamnopyranosyl-(1->2)-[beta-D-glucopyranosyl-(1->4)]-alpha-L-arabinopyranoside
Chemical ClassSaponin
Molecular Weight883.081
logP0.954
H-Bond Donor9.00
H-Bond Acceptor26
Caco-2 Permeability3.504
logSwat-4.498
Number of Primary Metabolites10
Polar Surface Area238.973
Rotatable Bonds16
logKhsa-0.918
Number of Reactive Functional Groups3
Number of Amides0
Number of Amines0
Number of Acids1
loghERG-3.479
Blood Brain Barrier (logBB)-3.772
CNS Permeability-2
Lipinski's RO5 Violations3
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   -
NPACT   NPACT00835
TaxKB   -
Structure Download

 






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