ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03361
Compound NameAculeatin E
Chemical ClassOxygen heterocycles
Molecular Weight390.562
logP5.429
H-Bond Donor1.00
H-Bond Acceptor5
Caco-2 Permeability1326.922
logSwat-6.643
Number of Primary Metabolites1
Polar Surface Area61.521
Rotatable Bonds11
logKhsa0.953
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.516
Blood Brain Barrier (logBB)-1.096
CNS Permeability-2
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations1
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol2564
NPACT   -
TaxKB   -
Structure Download

 






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