ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02785
Compound NameMontalicin B
Chemical ClassOxygen heterocycles
Molecular Weight580.887
logP7.565
H-Bond Donor3.00
H-Bond Acceptor10
Caco-2 Permeability356.157
logSwat-9.517
Number of Primary Metabolites6
Polar Surface Area104.990
Rotatable Bonds29
logKhsa1.200
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-6.929
Blood Brain Barrier (logBB)-3.413
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations1
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol1614
NPACT   -
TaxKB   -
Structure Download

 






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