| BioID | bio199192 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL389125 |
|---|
| Molecular Formula | C13H16O3 |
|---|
| Molecular Weight | 220.27 |
|---|
| Molecular Weight (Monoisotopic) | 220.1099 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 2-(3-Isobutyrylphenyl)Propanoic Acid |
|---|
| Smiles | CC(C)C(=O)c1cccc(C(C)C(=O)O)c1 |
|---|
| Inchi | InChI=1S/C13H16O3/c1-8(2)12(14)11-6-4-5-10(7-11)9(3)13(15)16/h4-9H,1-3H3,(H,15,16) |
|---|
| Inchi Key | QRXGHBLXUKJPTP-UHFFFAOYSA-N |
|---|
| Molecular Species | ACID |
|---|
| Targets | 1.0 |
|---|
| Bioactivities | 2.0 |
|---|
| Np Likeness Score | 0.24 |
|---|
| Records Key | ['24'] |
|---|
| Records Name | ['2-(3-isobutyrylphenyl)propanoic acid'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
