ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03046
Compound NameAnthricin isomer
Chemical ClassOxygen heterocycles
Molecular Weight398.412
logP3.028
H-Bond Donor0.00
H-Bond Acceptor7
Caco-2 Permeability3907.055
logSwat-3.046
Number of Primary Metabolites6
Polar Surface Area79.159
Rotatable Bonds3
logKhsa-0.114
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.618
Blood Brain Barrier (logBB)0.033
CNS Permeability1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2031
NPACT   -
TaxKB   -
Structure Download

 






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