General Information of the Compound
| Compound ID |
CP0442970
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-cycloheptyl-1-[(4-iodophenyl)methyl]-2-oxopyridine-3-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C20H23IN2O2
|
||||||||||||||||||
| Molecular Weight |
450.32
|
||||||||||||||||||
| Canonical SMILES |
Ic1ccc(Cn2cccc(C(=O)NC3CCCCCC3)c2=O)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C20H23IN2O2/c21-16-11-9-15(10-12-16)14-23-13-5-8-18(20(23)25)19(24)22-17-6-3-1-2-4-7-17/h5,8-13,17H,1-4,6-7,14H2,(H,22,24)
Show/Hide
|
||||||||||||||||||
| InChIKey |
SAXUWUSQYUVTQJ-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