7-Hydroxy-2-(4-Hydroxyphenyl)-2,3-Dihydrochromen-4-One
Representations & DB's id
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| ChEBI: | None | |
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| ChEMBL: | CHEMBL271939 | |
| PubChem: | 1889 | |
| IUPAC: | 7-hydroxy-2-(4-hydroxyphenyl)-2,3-dihydrochromen-4-one | |
| Standard InChI: | InChI=1S/C15H12O4/c16-10-3-1-9(2-4-10)14-8-13(18)12-6-5-11(17)7-15(12)19-14/h1-7,14,16-17H,8H2 | |
| Standard InChI Key: | FURUXTVZLHCCNA-UHFFFAOYSA-N | |
| SMILES: | Oc1ccc(cc1)C1CC(=O)c2c(O1)cc(cc2)O | |
Molecular propeties
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| AlogP: | 2.8 | |
|---|---|---|
| Hydrogen bonds acceptors: | 4 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 1 | |
| Number of rings: | 3 | |
| Molecular Weight: | 256.07 | |
| Topological polar surface area: | 66.8 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.133 | |
| Number of carbons: | 15 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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