ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03152
Compound Name(S)-pinocembrin
Chemical ClassFlavonoids
Molecular Weight256.257
logP2.379
H-Bond Donor1.00
H-Bond Acceptor3
Caco-2 Permeability427.484
logSwat-3.635
Number of Primary Metabolites5
Polar Surface Area78.255
Rotatable Bonds2
logKhsa0.137
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.012
Blood Brain Barrier (logBB)-0.820
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2221
NPACT   -
TaxKB   -
Structure Download

 






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