4-Carbomethoxy-6-Hydroxy-2-Quinolone
Representations & DB's id
| ||
| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL484460 | |
| PubChem: | 10331015 | |
| IUPAC: | methyl 6-hydroxy-2-oxo-1H-quinoline-4-carboxylate | |
| Standard InChI: | InChI=1S/C11H9NO4/c1-16-11(15)8-5-10(14)12-9-3-2-6(13)4-7(8)9/h2-5,13H,1H3,(H,12,14) | |
| Standard InChI Key: | VMFVSNYOKIVXJO-UHFFFAOYSA-N | |
| SMILES: | COC(=O)c1cc(O)nc2c1cc(O)cc2 | |
Molecular propeties
| ||
| AlogP: | 1.02 | |
|---|---|---|
| Hydrogen bonds acceptors: | 4 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 1 | |
| Number of rings: | 2 | |
| Molecular Weight: | 219.05 | |
| Topological polar surface area: | 75.6 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.091 | |
| Number of carbons: | 11 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
|---|