ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04440
Compound NameHederagenin
Chemical ClassSaponin
Molecular Weight472.707
logP5.254
H-Bond Donor3.00
H-Bond Acceptor5
Caco-2 Permeability126.788
logSwat-6.185
Number of Primary Metabolites4
Polar Surface Area85.099
Rotatable Bonds4
logKhsa1.007
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids1
loghERG-1.885
Blood Brain Barrier (logBB)-0.877
CNS Permeability-1
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT00647
TaxKB   -
Structure Download

 






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