ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID04206
Compound NameBenzoic acid alpha-L-arabinopyranosyl(1->6)-beta-D-glucopyranoside
Chemical ClassUnknown
Molecular Weight402.354
logP-2.356
H-Bond Donor6.00
H-Bond Acceptor17
Caco-2 Permeability11.586
logSwat-1.974
Number of Primary Metabolites6
Polar Surface Area190.688
Rotatable Bonds11
logKhsa-1.424
Number of Reactive Functional Groups4
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.620
Blood Brain Barrier (logBB)-3.280
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations1
Following Veber's ruleNo
Cross Reference
CancerHSP   -
NPACT   NPACT00316
TaxKB   -
Structure Download

 






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