8-(6-Hydroxy-1-Benzofuran-2-Yl)-2,2-Dimethylchromen-5-Ol
Representations & DB's id
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| ChEBI: | None | |
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| ChEMBL: | CHEMBL233147 | |
| PubChem: | 10542808 | |
| IUPAC: | 8-(6-hydroxy-1-benzofuran-2-yl)-2,2-dimethylchromen-5-ol | |
| Standard InChI: | InChI=1S/C19H16O4/c1-19(2)8-7-13-15(21)6-5-14(18(13)23-19)17-9-11-3-4-12(20)10-16(11)22-17/h3-10,20-21H,1-2H3 | |
| Standard InChI Key: | SJIZTMNAKZAOTA-UHFFFAOYSA-N | |
| SMILES: | Oc1ccc2c(c1)oc(c2)c1ccc(c2c1OC(C)(C)C=C2)O | |
Molecular propeties
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| AlogP: | 4.7 | |
|---|---|---|
| Hydrogen bonds acceptors: | 4 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 1 | |
| Number of rings: | 4 | |
| Molecular Weight: | 308.1 | |
| Topological polar surface area: | 62.8 | |
| Number of aromatic rings: | 3 | |
| Fsp3: | 0.158 | |
| Number of carbons: | 19 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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