ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02096
Compound Name14-Deacetyleurylene
Chemical ClassTerpenoids
Molecular Weight552.790
logP7.203
H-Bond Donor3.00
H-Bond Acceptor7
Caco-2 Permeability674.296
logSwat-8.581
Number of Primary Metabolites11
Polar Surface Area102.093
Rotatable Bonds17
logKhsa1.566
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.647
Blood Brain Barrier (logBB)-1.911
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol0775
NPACT   -
TaxKB   -
Structure Download

 






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