General Information of the Compound
| Compound ID |
CP0447875
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
2-[4-(4-acetylpiperazin-1-yl)phenoxy]-N-(5-pyrazin-2-ylpyridin-2-yl)acetamide
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H24N6O3
|
||||||||||||||||||
| Molecular Weight |
432.484
|
||||||||||||||||||
| Canonical SMILES |
CC(=O)N1CCN(CC1)c1ccc(OCC(=O)Nc2ccc(cn2)-c2cnccn2)cc1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H24N6O3/c1-17(30)28-10-12-29(13-11-28)19-3-5-20(6-4-19)32-16-23(31)27-22-7-2-18(14-26-22)21-15-24-8-9-25-21/h2-9,14-15H,10-13,16H2,1H3,(H,26,27,31)
Show/Hide
|
||||||||||||||||||
| InChIKey |
CDFKDSAHIOQTEA-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