General Information of the Compound
| Compound ID |
CP0547754
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
4-[(5-chloropyridin-2-yl)methoxy]-1-[2-[4-[(dimethylamino)methyl]phenyl]-2-oxoethyl]pyridin-2-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C22H22ClN3O3
|
||||||||||||||||||
| Molecular Weight |
411.889
|
||||||||||||||||||
| Canonical SMILES |
CN(C)Cc1ccc(cc1)C(=O)Cn1ccc(OCc2ccc(Cl)cn2)cc1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C22H22ClN3O3/c1-25(2)13-16-3-5-17(6-4-16)21(27)14-26-10-9-20(11-22(26)28)29-15-19-8-7-18(23)12-24-19/h3-12H,13-15H2,1-2H3
Show/Hide
|
||||||||||||||||||
| InChIKey |
SWFMGBWQYRQNOI-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