General Information of the Compound
| Compound ID |
CP0429740
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-cycloheptyl-1-[(4-fluorophenyl)methyl]-5-(4-methoxyphenyl)-2-oxo-4-phenylpyridine-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C33H33FN2O3
|
||||||||||||||||||
| Molecular Weight |
524.636
|
||||||||||||||||||
| Canonical SMILES |
COc1ccc(cc1)-c1cn(Cc2ccc(F)cc2)c(=O)c(C(=O)NC2CCCCCC2)c1-c1ccccc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C33H33FN2O3/c1-39-28-19-15-24(16-20-28)29-22-36(21-23-13-17-26(34)18-14-23)33(38)31(30(29)25-9-5-4-6-10-25)32(37)35-27-11-7-2-3-8-12-27/h4-6,9-10,13-20,22,27H,2-3,7-8,11-12,21H2,1H3,(H,35,37)
Show/Hide
|
||||||||||||||||||
| InChIKey |
UUAHJUJREZDEMZ-UHFFFAOYSA-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
Protein ID: PT01099, Fatty-acid amide hydrolase 1
Protein ID: PT06316, Lysophosphatidylserine lipase ABHD12
Protein ID: PT02720, Monoacylglycerol lipase ABHD6
Protein ID: PT01782, Monoglyceride lipase