ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01423
Compound Name(1S,5S,6R,7S,10S)-5-Angeloyloxy-1-hydroxy-2-oxoxantha-3,11-dien-6,12-olide
Chemical ClassTerpenoids
Molecular Weight362.422
logP2.542
H-Bond Donor1.00
H-Bond Acceptor8
Caco-2 Permeability650.257
logSwat-3.992
Number of Primary Metabolites5
Polar Surface Area106.190
Rotatable Bonds6
logKhsa0.009
Number of Reactive Functional Groups2
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.292
Blood Brain Barrier (logBB)-0.963
CNS Permeability-1
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT01481
TaxKB   -
Structure Download

 






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