ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID03345
Compound Name7beta-hydroxy-23-epi-acteol-3-O-alpha-l-arabinopyranoside
Chemical ClassUnknown
Molecular Weight618.806
logP3.166
H-Bond Donor4.00
H-Bond Acceptor14
Caco-2 Permeability339.798
logSwat-5.908
Number of Primary Metabolites4
Polar Surface Area126.491
Rotatable Bonds6
logKhsa0.415
Number of Reactive Functional Groups4
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-4.482
Blood Brain Barrier (logBB)-1.338
CNS Permeability-2
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations1
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol2543
NPACT   -
TaxKB   -
Structure Download

 






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