ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02356
Compound NameRotundifolioside J
Chemical ClassTerpenoids
Molecular Weight911.135
logP0.808
H-Bond Donor9.00
H-Bond Acceptor26
Caco-2 Permeability12.365
logSwat-5.012
Number of Primary Metabolites11
Polar Surface Area225.846
Rotatable Bonds16
logKhsa-0.649
Number of Reactive Functional Groups3
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.526
Blood Brain Barrier (logBB)-3.927
CNS Permeability-2
Lipinski's RO5 Violations3
Jorgensen's RO3 Violations2
Following Veber's ruleNo
Cross Reference
CancerHSP   Mol1082
NPACT   -
TaxKB   -
Structure Download

 






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