ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID00111
Compound Nametagitinin C
Chemical ClassOxygen heterocycles
Molecular Weight346.379
logP1.669
H-Bond Donor1.00
H-Bond Acceptor8
Caco-2 Permeability206.747
logSwat-3.477
Number of Primary Metabolites4
Polar Surface Area121.072
Rotatable Bonds4
logKhsa-0.110
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-3.878
Blood Brain Barrier (logBB)-1.233
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol0372
NPACT   -
TaxKB   -
Structure Download

 






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