ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02539
Compound NameGemichalcone C
Chemical ClassFlavonoids
Molecular Weight532.546
logP4.477
H-Bond Donor4.00
H-Bond Acceptor8
Caco-2 Permeability26.988
logSwat-6.917
Number of Primary Metabolites9
Polar Surface Area171.392
Rotatable Bonds17
logKhsa0.648
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-7.512
Blood Brain Barrier (logBB)-3.784
CNS Permeability-2
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol1317
NPACT   -
TaxKB   -
Structure Download

 






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