General Information of the Compound
Compound ID |
CP0890249
|
||||||||||||||||||
---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
Compound Name |
(E)-6-(3,4-Dimethoxyphenyl)4-oxohex-5-enoic acid piperedinamide
Show/Hide
|
||||||||||||||||||
Structure |
|
||||||||||||||||||
Formula |
C19H25NO4
|
||||||||||||||||||
Molecular Weight |
331.412
|
||||||||||||||||||
Canonical SMILES |
COc1ccc(/C=C/C(=O)CCC(=O)N2CCCCC2)cc1OC
Show/Hide
|
||||||||||||||||||
InChI |
InChI=1S/C19H25NO4/c1-23-17-10-7-15(14-18(17)24-2)6-8-16(21)9-11-19(22)20-12-4-3-5-13-20/h6-8,10,14H,3-5,9,11-13H2,1-2H3/b8-6+
Show/Hide
|
||||||||||||||||||
InChIKey |
PPMHQBISMUKOLP-SOFGYWHQSA-N
|
||||||||||||||||||
Physicochemical Property |
"RO5" indicates the cutoff set by lipinski's rule of five: (1) Molecular weight less than 500 Dalton; (2) xlogp less than 5; (3) No more than 5 hbonddonor (Hydrogen Bond Donor Count); (4) No more than 10 hbondacc (Hydrogen Bond Acceptor Count); (5) No more than 10 rotbonds (Rotatable Bond Count). Show/Hide
|
||||||||||||||||||
Click to Show/Hide the External Link(s) of This Compound | |||||||||||||||||||
PubChem ID | |||||||||||||||||||
ChEMBL ID |
Map of Molecular Bioactivity Related to the Compound
Map of Molecular Bioactivity Related to the Compound Compound Cell Line Protein Bioactivity Value: <= 0.1 μM > 0.1 μM and <= 10 μM > 10 μM Imprecise Activity |
|
---|
Table of Molecular Bioactivities Related to the Compound
Protein ID: PT01298, Cannabinoid receptor 1
Protein ID: PT00834, Cannabinoid receptor 2