ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03262
Compound Name3-O-b-D-glucopyranosyl-(1->4)-O-a-L-rhamnopyranosyl-(1->2)-O-a-L-arabinopyranosyl hederagenin
Chemical ClassTerpenoids
Molecular Weight911.135
logP0.966
H-Bond Donor10.00
H-Bond Acceptor26
Caco-2 Permeability1.410
logSwat-4.350
Number of Primary Metabolites12
Polar Surface Area262.372
Rotatable Bonds18
logKhsa-0.857
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids1
loghERG-3.409
Blood Brain Barrier (logBB)-4.314
CNS Permeability-2
Lipinski's RO5 Violations3
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol2396
NPACT   -
TaxKB   -
Structure Download

 






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