ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03261
Compound Name3-O-b-D-glucopyranosyl(1->4)-b-D-glucopyranosyl(1->3)-a-L-rhamnopyranosyl(1->2)-a-L-arabinopyranosyl oleanolic acid
Chemical ClassTerpenoids
Molecular Weight1057.277
logP-0.176
H-Bond Donor12.00
H-Bond Acceptor33
Caco-2 Permeability0.225
logSwat-5.085
Number of Primary Metabolites14
Polar Surface Area325.571
Rotatable Bonds22
logKhsa-1.502
Number of Reactive Functional Groups3
Number of Amides0
Number of Amines0
Number of Acids1
loghERG-4.491
Blood Brain Barrier (logBB)-6.418
CNS Permeability-2
Lipinski's RO5 Violations3
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol2395
NPACT   -
TaxKB   -
Structure Download

 






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