General Information of the Compound
| Compound ID |
CP0374319
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
3-Cyano-N-(6-methylpyridin-2-yl)-4-(pyridine-3-yl)-benzamid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C19H14N4O
|
||||||||||||||||||
| Molecular Weight |
314.348
|
||||||||||||||||||
| Canonical SMILES |
Cc1cccc(NC(=O)c2ccc(-c3cccnc3)c(c2)C#N)n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C19H14N4O/c1-13-4-2-6-18(22-13)23-19(24)14-7-8-17(16(10-14)11-20)15-5-3-9-21-12-15/h2-10,12H,1H3,(H,22,23,24)
Show/Hide
|
||||||||||||||||||
| InChIKey |
PPYNQJKVTBNACU-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