ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03097
Compound NameProcyanidin C1-3,3',3''-tri-O-gallate
Chemical ClassFlavonoids
Molecular Weight1323.103
logP-0.512
H-Bond Donor21.00
H-Bond Acceptor24
Caco-2 Permeability0.000
logSwat-4.743
Number of Primary Metabolites27
Polar Surface Area565.190
Rotatable Bonds27
logKhsa-0.434
Number of Reactive Functional Groups3
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-7.814
Blood Brain Barrier (logBB)-11.298
CNS Permeability-2
Lipinski's RO5 Violations3
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol2135
NPACT   -
TaxKB   -
Structure Download

 






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