ADMETCan- Database of Predicted ADMET for AntiCancer Phytomolecules
Compound IDCID01004
Compound Name12-O-Methylcarnosicacid
Chemical ClassTerpenoids
Molecular Weight346.466
logP4.525
H-Bond Donor2.00
H-Bond Acceptor4
Caco-2 Permeability479.559
logSwat-4.881
Number of Primary Metabolites4
Polar Surface Area61.472
Rotatable Bonds4
logKhsa0.527
Number of Reactive Functional Groups0
Number of Amides0
Number of Amines0
Number of Acids1
loghERG-1.818
Blood Brain Barrier (logBB)-0.335
CNS Permeability-1
Lipinski's RO5 Violations0
Jorgensen's RO3 Violations0
Following Veber's ruleYes
Cross Reference
CancerHSP   -
NPACT   NPACT00040
TaxKB   -
Structure Download

 






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