ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00412
Compound NameAnticancer Rotenoid PMV70P691-036
Chemical ClassFlavonoids
Molecular Weight474.463
logP2.637
H-Bond Donor2.00
H-Bond Acceptor10
Caco-2 Permeability516.354
logSwat-4.478
Number of Primary Metabolites6
Polar Surface Area126.028
Rotatable Bonds6
logKhsa0.089
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.599
Blood Brain Barrier (logBB)-1.080
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1272
NPACT   -
TaxKB   -
Structure Download

 






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