ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04732
Compound Name[3]-Dehydroparadol
Chemical ClassOrganic Chemicals
Molecular Weight276.375
logP3.987
H-Bond Donor1.00
H-Bond Acceptor4
Caco-2 Permeability1106.491
logSwat-4.849
Number of Primary Metabolites3
Polar Surface Area57.322
Rotatable Bonds11
logKhsa0.382
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.489
Blood Brain Barrier (logBB)-1.163
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleNo
Cross Reference
CancerHSP   -
NPACT   NPACT01056
TaxKB   -
Structure Download

 






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