3,8-Dihydroxybenzo[C]Chromen-6-One
Representations & DB's id
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| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL1836264 | |
| PubChem: | 5488186 | |
| IUPAC: | 3,8-dihydroxybenzo[c]chromen-6-one | |
| Standard InChI: | InChI=1S/C13H8O4/c14-7-1-3-9-10-4-2-8(15)6-12(10)17-13(16)11(9)5-7/h1-6,14-15H | |
| Standard InChI Key: | RIUPLDUFZCXCHM-UHFFFAOYSA-N | |
| SMILES: | Oc1ccc2c(c1)oc(=O)c1c2ccc(c1)O | |
Molecular propeties
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| AlogP: | 2.36 | |
|---|---|---|
| Hydrogen bonds acceptors: | 4 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 0 | |
| Number of rings: | 3 | |
| Molecular Weight: | 228.04 | |
| Topological polar surface area: | 66.8 | |
| Number of aromatic rings: | 3 | |
| Fsp3: | 0 | |
| Number of carbons: | 13 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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