ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00767
Compound Name4,5-epoxovatodiolide
Chemical ClassTerpenoids
Molecular Weight344.407
logP1.361
H-Bond Donor0.00
H-Bond Acceptor8
Caco-2 Permeability634.570
logSwat-2.220
Number of Primary Metabolites6
Polar Surface Area91.871
Rotatable Bonds1
logKhsa-0.547
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.234
Blood Brain Barrier (logBB)-0.514
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2465
NPACT   -
TaxKB   -
Structure Download

 






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