ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02460
Compound Name5,3'-Dipent-4-enoyloxy-3,6,7,4'-tetrame-thoxyflavone
Chemical ClassFlavonoids
Molecular Weight538.550
logP4.798
H-Bond Donor0.00
H-Bond Acceptor11
Caco-2 Permeability1807.594
logSwat-5.489
Number of Primary Metabolites8
Polar Surface Area127.494
Rotatable Bonds12
logKhsa0.157
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-6.192
Blood Brain Barrier (logBB)-1.030
CNS Permeability-2
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations1
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol1221
NPACT   -
TaxKB   -
Structure Download

 






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