ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01270
Compound NameWithaferin A
Chemical ClassOxygen heterocycles
Molecular Weight470.605
logP3.089
H-Bond Donor1.00
H-Bond Acceptor9
Caco-2 Permeability230.760
logSwat-5.001
Number of Primary Metabolites4
Polar Surface Area116.246
Rotatable Bonds5
logKhsa0.364
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.396
Blood Brain Barrier (logBB)-1.341
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT01018
TaxKB   -
Structure Download

 






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