ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02365
Compound NameNeokadsuranic acid A
Chemical ClassTerpenoids
Molecular Weight452.676
logP6.833
H-Bond Donor1.00
H-Bond Acceptor4
Caco-2 Permeability147.870
logSwat-8.476
Number of Primary Metabolites6
Polar Surface Area72.869
Rotatable Bonds5
logKhsa1.607
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids1
loghERG-3.155
Blood Brain Barrier (logBB)-1.080
CNS Permeability-2
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1091
NPACT   -
TaxKB   -
Structure Download

 






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