(2-Oxo-3-Indolyl)-Acetic Acid
Representations & DB's id
| ||
| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL443641 | |
| PubChem: | 3080590 | |
| IUPAC: | 2-(2-oxo-1,3-dihydroindol-3-yl)acetic acid | |
| Standard InChI: | InChI=1S/C10H9NO3/c12-9(13)5-7-6-3-1-2-4-8(6)11-10(7)14/h1-4,7H,5H2,(H,11,14)(H,12,13) | |
| Standard InChI Key: | ILGMGHZPXRDCCS-UHFFFAOYSA-N | |
| SMILES: | OC(=O)CC1C(=Nc2c1cccc2)O | |
Molecular propeties
| ||
| AlogP: | 1.2 | |
|---|---|---|
| Hydrogen bonds acceptors: | 2 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 2 | |
| Number of rings: | 2 | |
| Molecular Weight: | 191.06 | |
| Topological polar surface area: | 66.4 | |
| Number of aromatic rings: | 1 | |
| Fsp3: | 0.1 | |
| Number of carbons: | 10 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
|---|