ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01727
Compound Nameemetine
Chemical ClassAlkaloids
Molecular Weight480.646
logP5.214
H-Bond Donor1.00
H-Bond Acceptor7
Caco-2 Permeability368.286
logSwat-5.428
Number of Primary Metabolites8
Polar Surface Area50.084
Rotatable Bonds7
logKhsa1.247
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines2
Number of Acids0
loghERG-7.053
Blood Brain Barrier (logBB)0.679
CNS Permeability2
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol0056
NPACT   -
TaxKB   -
Structure Download

 






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