ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02604
Compound Name(22S)-Cholest-5-ene-3alpha,11alpha,16beta,22-tetrol 16-O-alpha-L-rhamnopyranoside
Chemical ClassUnknown
Molecular Weight580.801
logP2.783
H-Bond Donor6.00
H-Bond Acceptor14
Caco-2 Permeability84.115
logSwat-5.758
Number of Primary Metabolites8
Polar Surface Area136.318
Rotatable Bonds13
logKhsa0.125
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.332
Blood Brain Barrier (logBB)-2.658
CNS Permeability-2
Lipinski's RO5 Violations2
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol1407
NPACT   -
TaxKB   -
Structure Download

 






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