ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04150
Compound NameAlvaradoins J
Chemical ClassPolycyclic aromatic natural products
Molecular Weight528.512
logP1.848
H-Bond Donor3.00
H-Bond Acceptor11
Caco-2 Permeability36.055
logSwat-3.892
Number of Primary Metabolites10
Polar Surface Area197.295
Rotatable Bonds8
logKhsa0.059
Number of Reactive Functional Groups3
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.290
Blood Brain Barrier (logBB)-2.165
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations1
Following Veber's ruleNo
Cross Reference
CancerHSP   -
NPACT   NPACT00251
TaxKB   -
Structure Download

 






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