ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01005
Compound Name15-epi-4E-jatrogrossidentadion
Chemical ClassTerpenoids
Molecular Weight332.439
logP2.887
H-Bond Donor2.00
H-Bond Acceptor6
Caco-2 Permeability763.725
logSwat-4.535
Number of Primary Metabolites4
Polar Surface Area81.388
Rotatable Bonds2
logKhsa0.413
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.627
Blood Brain Barrier (logBB)-0.570
CNS Permeability0
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT00044
TaxKB   -
Structure Download

 






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