ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01001
Compound Name1,3-diacetylvilasinin
Chemical ClassTerpenoids
Molecular Weight512.642
logP4.419
H-Bond Donor1.00
H-Bond Acceptor8
Caco-2 Permeability686.958
logSwat-5.689
Number of Primary Metabolites5
Polar Surface Area109.412
Rotatable Bonds3
logKhsa0.888
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.161
Blood Brain Barrier (logBB)-0.675
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT00026
TaxKB   -
Structure Download

 






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