General Information of the Compound
| Compound ID |
CP0957032
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
6-(8-fluoro-2-naphthyl)-3-[2-methyl-1-[(E)-(2-oxopyrrolidin-3-ylidene)methyl]propyl]-1H-pyridin-2-one
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C24H23FN2O2
|
||||||||||||||||||
| Molecular Weight |
390.458
|
||||||||||||||||||
| Canonical SMILES |
CC(C)C(/C=C1\CCNC1=O)c1ccc(-c2ccc3cccc(F)c3c2)[nH]c1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C24H23FN2O2/c1-14(2)19(13-17-10-11-26-23(17)28)18-8-9-22(27-24(18)29)16-7-6-15-4-3-5-21(25)20(15)12-16/h3-9,12-14,19H,10-11H2,1-2H3,(H,26,28)(H,27,29)/b17-13+
Show/Hide
|
||||||||||||||||||
| InChIKey |
SYAXGJOJMZPSRW-GHRIWEEISA-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