Bioactive Compound Details
| BioID | bio198713 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL2059002 |
| Molecular Formula | C9H7BrO5 |
| Molecular Weight | 275.05 |
| Molecular Weight (Monoisotopic) | 273.9477 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2-(4-Bromophenoxy)Malonic Acid |
| Smiles | O=C(O)C(Oc1ccc(Br)cc1)C(=O)O |
| Inchi | InChI=1S/C9H7BrO5/c10-5-1-3-6(4-2-5)15-7(8(11)12)9(13)14/h1-4,7H,(H,11,12)(H,13,14) |
| Inchi Key | GZMFZHIPGZSUHI-UHFFFAOYSA-N |
| Molecular Species | ACID |
| Targets | 1.0 |
| Bioactivities | 3.0 |
| Np Likeness Score | -0.19 |
| Records Key | ['20'] |
| Records Name | ['2-(4-bromophenoxy)malonic acid'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
