ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01230
Compound NamePlumbagin
Chemical ClassPolycyclic aromatic natural products
Molecular Weight188.182
logP0.793
H-Bond Donor0.00
H-Bond Acceptor4
Caco-2 Permeability478.167
logSwat-1.372
Number of Primary Metabolites2
Polar Surface Area75.477
Rotatable Bonds1
logKhsa-0.607
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.754
Blood Brain Barrier (logBB)-0.610
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT00870
TaxKB   -
Structure Download

 






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