ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00923
Compound Namegoniotriol
Chemical ClassOxygen heterocycles
Molecular Weight250.251
logP0.170
H-Bond Donor3.00
H-Bond Acceptor8
Caco-2 Permeability315.121
logSwat-1.474
Number of Primary Metabolites4
Polar Surface Area97.559
Rotatable Bonds6
logKhsa-0.718
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.074
Blood Brain Barrier (logBB)-1.061
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol3332
NPACT   -
TaxKB   -
Structure Download

 






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