ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04977
Compound Name(2S)-5,7-Dimethoxy-8-(2S-hydroxy-3-methyl-3-butenyl)-flavanone
Chemical ClassFlavonoids
Molecular Weight368.429
logP4.039
H-Bond Donor1.00
H-Bond Acceptor6
Caco-2 Permeability1915.006
logSwat-4.961
Number of Primary Metabolites8
Polar Surface Area65.176
Rotatable Bonds6
logKhsa0.449
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.270
Blood Brain Barrier (logBB)-0.515
CNS Permeability0
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT01414
TaxKB   -
Structure Download

 






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