ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03733
Compound Namechalcone derivative compound 1
Chemical ClassFlavonoids
Molecular Weight394.599
logP8.694
H-Bond Donor0.00
H-Bond Acceptor0
Caco-2 Permeability9906.038
logSwat-11.602
Number of Primary Metabolites8
Polar Surface Area0.000
Rotatable Bonds6
logKhsa2.208
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.305
Blood Brain Barrier (logBB)1.123
CNS Permeability2
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations2
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol3220
NPACT   -
TaxKB   -
Structure Download

 






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