ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02930
Compound Name3'-Methoxynyasin
Chemical ClassOrganic Chemicals
Molecular Weight282.338
logP4.729
H-Bond Donor2.00
H-Bond Acceptor2
Caco-2 Permeability923.131
logSwat-4.475
Number of Primary Metabolites4
Polar Surface Area52.493
Rotatable Bonds7
logKhsa0.475
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.778
Blood Brain Barrier (logBB)-0.925
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1827
NPACT   -
TaxKB   -
Structure Download

 






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