ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID02547
Compound Name7-O-Methoxypraecansone B
Chemical ClassOrganic Chemicals
Molecular Weight380.440
logP5.077
H-Bond Donor0.00
H-Bond Acceptor5
Caco-2 Permeability5273.281
logSwat-5.513
Number of Primary Metabolites2
Polar Surface Area50.631
Rotatable Bonds7
logKhsa0.588
Number of Reactive Functional Groups1
Number of Amides0
Number of Amines0
Number of Acids0
loghERG-5.875
Blood Brain Barrier (logBB)-0.151
CNS Permeability0
Lipinski's RO5 Violations1
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   Mol1325
NPACT   -
TaxKB   -
Structure Download

 






Copyright © 2018. Subhash M. Agarwal. All Rights Reserved.