ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00697
Compound Name1,2-dihydroxy-6,7,8-trimethoxyxanthone
Chemical ClassPolycyclic aromatic natural products
Molecular Weight318.282
logP2.182
H-Bond Donor1.00
H-Bond Acceptor5
Caco-2 Permeability730.931
logSwat-3.057
Number of Primary Metabolites5
Polar Surface Area95.022
Rotatable Bonds5
logKhsa-0.105
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.284
Blood Brain Barrier (logBB)-0.770
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2228
NPACT   -
TaxKB   -
Structure Download

 






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