ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04968
Compound NameIsochamuvaretin
Chemical ClassFlavonoids
Molecular Weight452.506
logP6.113
H-Bond Donor2.00
H-Bond Acceptor4
Caco-2 Permeability751.127
logSwat-7.266
Number of Primary Metabolites7
Polar Surface Area84.013
Rotatable Bonds9
logKhsa1.221
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-7.589
Blood Brain Barrier (logBB)-1.256
CNS Permeability-2
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations2
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT01403
TaxKB   -
Structure Download

 






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