ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01125
Compound NameDielsiquinone
Chemical ClassPolycyclic aromatic natural products
Molecular Weight269.256
logP0.835
H-Bond Donor0.00
H-Bond Acceptor7
Caco-2 Permeability368.983
logSwat-2.226
Number of Primary Metabolites2
Polar Surface Area99.777
Rotatable Bonds1
logKhsa-0.549
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.187
Blood Brain Barrier (logBB)-0.769
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT00502
TaxKB   -
Structure Download

 






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