ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02307
Compound NameIxerissaponin B
Chemical ClassSaponin
Molecular Weight1091.249
logP-3.149
H-Bond Donor13.00
H-Bond Acceptor37
Caco-2 Permeability0.143
logSwat-2.339
Number of Primary Metabolites16
Polar Surface Area362.986
Rotatable Bonds25
logKhsa-2.061
Number of Reactive Functional Groups4
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.662
Blood Brain Barrier (logBB)-7.016
CNS Permeability-2
Lipinski's RO5 Violations3
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol1014
NPACT   -
TaxKB   -
Structure Download

 






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