ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02375
Compound NameLupulone
Chemical ClassTerpenoids
Molecular Weight414.584
logP6.056
H-Bond Donor1.00
H-Bond Acceptor5
Caco-2 Permeability2733.705
logSwat-6.164
Number of Primary Metabolites12
Polar Surface Area72.400
Rotatable Bonds11
logKhsa1.191
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.267
Blood Brain Barrier (logBB)-0.657
CNS Permeability0
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol1109
NPACT   -
TaxKB   -
Structure Download

 






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