ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04041
Compound Name3,5,7,3',4',5'-hexahydroxy flavanone-3-O-beta-D-glucopyranoside
Chemical ClassFlavonoids
Molecular Weight482.397
logP-2.339
H-Bond Donor8.00
H-Bond Acceptor16
Caco-2 Permeability1.125
logSwat-2.053
Number of Primary Metabolites11
Polar Surface Area239.527
Rotatable Bonds12
logKhsa-1.029
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.660
Blood Brain Barrier (logBB)-3.999
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   -
NPACT   NPACT00105
TaxKB   -
Structure Download

 






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