ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04046
Compound Name3,6-Epidioxy-1,10-bisaboladiene
Chemical ClassTerpenoids
Molecular Weight236.353
logP4.399
H-Bond Donor0.00
H-Bond Acceptor2
Caco-2 Permeability4958.420
logSwat-4.892
Number of Primary Metabolites3
Polar Surface Area21.731
Rotatable Bonds4
logKhsa0.707
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.181
Blood Brain Barrier (logBB)0.033
CNS Permeability1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT00110
TaxKB   -
Structure Download

 






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