ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01360
Compound NamePurpurin
Chemical ClassPolycyclic aromatic natural products
Molecular Weight256.214
logP1.012
H-Bond Donor1.00
H-Bond Acceptor4
Caco-2 Permeability99.037
logSwat-2.454
Number of Primary Metabolites3
Polar Surface Area113.982
Rotatable Bonds3
logKhsa-0.257
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.321
Blood Brain Barrier (logBB)-1.369
CNS Permeability-2
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT01304
TaxKB   -
Structure Download

 






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