General Information of the Compound
| Compound ID |
CP0949383
|
||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Compound Name |
5-fluoro-4-oxo-1-(4-(4-phenyl-1H-imidazol-1-yl)benzyl)-1,4-dihydroquinoline-3-carboxylic acid
Show/Hide
|
||||||||||||||||||
| Structure |
|
||||||||||||||||||
| Formula |
C26H18FN3O3
|
||||||||||||||||||
| Molecular Weight |
439.446
|
||||||||||||||||||
| Canonical SMILES |
O=C(O)c1cn(Cc2ccc(-n3cnc(-c4ccccc4)c3)cc2)c2cccc(F)c2c1=O
Show/Hide
|
||||||||||||||||||
| InChI |
InChI=1S/C26H18FN3O3/c27-21-7-4-8-23-24(21)25(31)20(26(32)33)14-29(23)13-17-9-11-19(12-10-17)30-15-22(28-16-30)18-5-2-1-3-6-18/h1-12,14-16H,13H2,(H,32,33)
Show/Hide
|
||||||||||||||||||
| InChIKey |
GZTBTVOKHNCDLW-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