ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03078
Compound NameInteriotherin B
Chemical ClassLignans
Molecular Weight498.529
logP4.263
H-Bond Donor1.00
H-Bond Acceptor7
Caco-2 Permeability2923.869
logSwat-4.700
Number of Primary Metabolites7
Polar Surface Area93.924
Rotatable Bonds5
logKhsa0.604
Number of Reactive Functional Groups3
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.528
Blood Brain Barrier (logBB)-0.206
CNS Permeability0
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2100
NPACT   -
TaxKB   -
Structure Download

 






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