ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02784
Compound NameMontalicin A
Chemical ClassOxygen heterocycles
Molecular Weight552.833
logP6.762
H-Bond Donor3.00
H-Bond Acceptor10
Caco-2 Permeability380.024
logSwat-8.533
Number of Primary Metabolites6
Polar Surface Area107.044
Rotatable Bonds27
logKhsa0.940
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-6.694
Blood Brain Barrier (logBB)-3.157
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations1
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol1613
NPACT   -
TaxKB   -
Structure Download

 






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