3-(Hydroxyacetyl)Indole
Representations & DB's id
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| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL524903 | |
| PubChem: | 200631 | |
| IUPAC: | 2-hydroxy-1-(1H-indol-3-yl)ethanone | |
| Standard InChI: | InChI=1S/C10H9NO2/c12-6-10(13)8-5-11-9-4-2-1-3-7(8)9/h1-5,11-12H,6H2 | |
| Standard InChI Key: | IBLZDDPFMAFWKP-UHFFFAOYSA-N | |
| SMILES: | OCC(=O)c1c[nH]c2c1cccc2 | |
Molecular propeties
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| AlogP: | 1.34 | |
|---|---|---|
| Hydrogen bonds acceptors: | 2 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 2 | |
| Number of rings: | 2 | |
| Molecular Weight: | 175.06 | |
| Topological polar surface area: | 53.1 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.1 | |
| Number of carbons: | 10 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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