ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04009
Compound Name1-deoxy-3-methacrylyl-11-methoxymeliacarpinin
Chemical ClassTerpenoids
Molecular Weight618.677
logP2.780
H-Bond Donor2.00
H-Bond Acceptor13
Caco-2 Permeability255.589
logSwat-4.740
Number of Primary Metabolites5
Polar Surface Area139.790
Rotatable Bonds6
logKhsa0.175
Number of Reactive Functional Groups3
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.479
Blood Brain Barrier (logBB)-1.350
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT00056
TaxKB   -
Structure Download

 






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