ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01038
Compound Name4E-jatrogrossidentadion
Chemical ClassTerpenoids
Molecular Weight332.439
logP2.574
H-Bond Donor2.00
H-Bond Acceptor6
Caco-2 Permeability587.635
logSwat-3.844
Number of Primary Metabolites4
Polar Surface Area84.930
Rotatable Bonds2
logKhsa0.338
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-2.892
Blood Brain Barrier (logBB)-0.569
CNS Permeability0
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT00160
TaxKB   -
Structure Download

 






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