General Information of the Compound
| Compound ID |
CP0953583
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-(8-fluoro-2-naphthyl)-3-[2-methyl-1-(4-methyl-1H-imidazol-2-yl)propyl]-1H-pyridin-2-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C23H22FN3O
|
||||||||||||||||||
| Molecular Weight |
375.447
|
||||||||||||||||||
| Canonical SMILES |
Cc1c[nH]c(C(c2ccc(-c3ccc4cccc(F)c4c3)[nH]c2=O)C(C)C)n1
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C23H22FN3O/c1-13(2)21(22-25-12-14(3)26-22)17-9-10-20(27-23(17)28)16-8-7-15-5-4-6-19(24)18(15)11-16/h4-13,21H,1-3H3,(H,25,26)(H,27,28)
Show/Hide
|
||||||||||||||||||
| InChIKey |
YECGYSITIVNLNO-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