ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01741
Compound Nameneoharringtonine
Chemical ClassAlkaloids
Molecular Weight535.593
logP4.573
H-Bond Donor0.00
H-Bond Acceptor7
Caco-2 Permeability252.693
logSwat-3.816
Number of Primary Metabolites6
Polar Surface Area111.357
Rotatable Bonds8
logKhsa0.735
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines1
Number of Acids0
loghERG-5.243
Blood Brain Barrier (logBB)-0.445
CNS Permeability1
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol0082
NPACT   -
TaxKB   -
Structure Download

 






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