General Information of the Compound
| Compound ID |
CP0374432
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
N-[4-cyano-3-(trifluoromethyl)phenyl]pyridine-2-carboxamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C14H8F3N3O
|
||||||||||||||||||
| Molecular Weight |
291.232
|
||||||||||||||||||
| Canonical SMILES |
FC(F)(F)c1cc(NC(=O)c2ccccn2)ccc1C#N
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C14H8F3N3O/c15-14(16,17)11-7-10(5-4-9(11)8-18)20-13(21)12-3-1-2-6-19-12/h1-7H,(H,20,21)
Show/Hide
|
||||||||||||||||||
| InChIKey |
YNSZFIUHHIUANF-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: PT02446, Metabotropic glutamate receptor 4
Protein ID: PT02199, Metabotropic glutamate receptor 4