Dioxane
Representations & DB's id
| ||
| ChEBI: | CHEBI:47032 | |
|---|---|---|
| ChEMBL: | CHEMBL453716 | |
| PubChem: | 31275 | |
| IUPAC: | 1,4-dioxane | |
| Standard InChI: | InChI=1S/C4H8O2/c1-2-6-4-3-5-1/h1-4H2 | |
| Standard InChI Key: | RYHBNJHYFVUHQT-UHFFFAOYSA-N | |
| SMILES: | O1CCOCC1 | |
Molecular propeties
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| AlogP: | 0.03 | |
|---|---|---|
| Hydrogen bonds acceptors: | 2 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 0 | |
| Number of rings: | 1 | |
| Molecular Weight: | 88.05 | |
| Topological polar surface area: | 18.5 | |
| Number of aromatic rings: | 0 | |
| Fsp3: | 1 | |
| Number of carbons: | 4 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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