ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01981
Compound Name5alpha-hydroxytriptonide
Chemical ClassTerpenoids
Molecular Weight374.390
logP-0.187
H-Bond Donor0.00
H-Bond Acceptor11
Caco-2 Permeability763.733
logSwat0.055
Number of Primary Metabolites3
Polar Surface Area119.146
Rotatable Bonds2
logKhsa-1.422
Number of Reactive Functional Groups5
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-2.341
Blood Brain Barrier (logBB)-0.423
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol0520
NPACT   -
TaxKB   -
Structure Download

 






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