ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00940
Compound Namekamebakaurinin
Chemical ClassTerpenoids
Molecular Weight350.454
logP1.520
H-Bond Donor3.00
H-Bond Acceptor8
Caco-2 Permeability260.505
logSwat-2.864
Number of Primary Metabolites5
Polar Surface Area99.758
Rotatable Bonds6
logKhsa-0.141
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-2.890
Blood Brain Barrier (logBB)-1.099
CNS Permeability-2
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol3393
NPACT   -
TaxKB   -
Structure Download

 






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