Butane-1,2,3,4-Tetrol
Representations & DB's id
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| ChEBI: | CHEBI:48299 | |
|---|---|---|
| ChEMBL: | CHEMBL402812 | |
| PubChem: | 8998 | |
| IUPAC: | butane-1,2,3,4-tetrol | |
| Standard InChI: | InChI=1S/C4H10O4/c5-1-3(7)4(8)2-6/h3-8H,1-2H2 | |
| Standard InChI Key: | UNXHWFMMPAWVPI-UHFFFAOYSA-N | |
| SMILES: | OCC(C(CO)O)O | |
Molecular propeties
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| AlogP: | -2.31 | |
|---|---|---|
| Hydrogen bonds acceptors: | 4 | |
| Hydrogen bonds donors: | 4 | |
| Rotatable bonds: | 3 | |
| Number of rings: | 0 | |
| Molecular Weight: | 122.06 | |
| Topological polar surface area: | 80.9 | |
| 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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