ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00789
Compound Name7-acetylgoniodiol
Chemical ClassOxygen heterocycles
Molecular Weight276.288
logP1.607
H-Bond Donor1.00
H-Bond Acceptor7
Caco-2 Permeability543.113
logSwat-2.727
Number of Primary Metabolites3
Polar Surface Area93.029
Rotatable Bonds5
logKhsa-0.373
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.871
Blood Brain Barrier (logBB)-0.923
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2531
NPACT   -
TaxKB   -
Structure Download

 






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