| BioID | bio197848 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL2337713 |
|---|
| Molecular Formula | C10H6Na2O4 |
|---|
| Molecular Weight | 236.13 |
|---|
| Molecular Weight (Monoisotopic) | 192.0423 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | Sodium 3-(2-Carboxyvinyl)Benzoate |
|---|
| Smiles | O=C([O-])/C=C/c1cccc(C(=O)[O-])c1.[Na+].[Na+] |
|---|
| Inchi | InChI=1S/C10H8O4.2Na/c11-9(12)5-4-7-2-1-3-8(6-7)10(13)14;;/h1-6H,(H,11,12)(H,13,14);;/q;2*+1/p-2/b5-4+;; |
|---|
| Inchi Key | FXIPJBVUVYTONA-SFKRKKMESA-L |
|---|
| Molecular Species | ACID |
|---|
| Targets | 2.0 |
|---|
| Bioactivities | 5.0 |
|---|
| Np Likeness Score | 0.43 |
|---|
| Records Key | ['3'] |
|---|
| Records Name | ['sodium 3-(2-carboxyvinyl)benzoate'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
