ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02829
Compound NameGoniobutenolide B
Chemical ClassOxygen heterocycles
Molecular Weight232.235
logP1.020
H-Bond Donor2.00
H-Bond Acceptor6
Caco-2 Permeability368.559
logSwat-2.338
Number of Primary Metabolites3
Polar Surface Area82.069
Rotatable Bonds6
logKhsa-0.553
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.378
Blood Brain Barrier (logBB)-1.198
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1660
NPACT   -
TaxKB   -
Structure Download

 






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