Bioactive Compound Details
| BioID | bio198588 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL152123 |
| Molecular Formula | C10H12N2O3 |
| Molecular Weight | 208.22 |
| Molecular Weight (Monoisotopic) | 208.0848 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 3-[(2-Ammoniopropanoyl)Amino]Benzoate |
| Smiles | CC(N)C(=O)Nc1cccc(C(=O)O)c1 |
| Inchi | InChI=1S/C10H12N2O3/c1-6(11)9(13)12-8-4-2-3-7(5-8)10(14)15/h2-6H,11H2,1H3,(H,12,13)(H,14,15) |
| Inchi Key | QYHWEHIYCYSEHK-UHFFFAOYSA-N |
| Molecular Species | ACID |
| Targets | 1.0 |
| Bioactivities | 1.0 |
| Np Likeness Score | -1.04 |
| Records Key | ['27'] |
| Records Name | ['3-[(2-ammoniopropanoyl)amino]benzoate'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
