ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03325
Compound Name6-(3-hydroxy-4-methoxystyryl)-4-methoxy-2H-pyran-2-one
Chemical ClassUnknown
Molecular Weight274.273
logP2.287
H-Bond Donor1.00
H-Bond Acceptor5
Caco-2 Permeability633.584
logSwat-3.440
Number of Primary Metabolites3
Polar Surface Area77.422
Rotatable Bonds6
logKhsa-0.110
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.202
Blood Brain Barrier (logBB)-1.004
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2508
NPACT   -
TaxKB   -
Structure Download

 






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