ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04887
Compound NameNeorautenol
Chemical ClassFlavonoids
Molecular Weight322.360
logP4.193
H-Bond Donor1.00
H-Bond Acceptor3
Caco-2 Permeability3001.632
logSwat-5.354
Number of Primary Metabolites3
Polar Surface Area46.674
Rotatable Bonds1
logKhsa0.704
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.244
Blood Brain Barrier (logBB)-0.002
CNS Permeability0
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT01283
TaxKB   -
Structure Download

 






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