ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02222
Compound NameBruceantin
Chemical ClassTerpenoids
Molecular Weight548.586
logP1.609
H-Bond Donor2.00
H-Bond Acceptor13
Caco-2 Permeability73.584
logSwat-3.373
Number of Primary Metabolites10
Polar Surface Area186.808
Rotatable Bonds7
logKhsa-0.102
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.269
Blood Brain Barrier (logBB)-1.730
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations1
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol0914
NPACT   -
TaxKB   -
Structure Download

 






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