Anthrone
Representations & DB's id
| ||
| ChEBI: | CHEBI:33835 | |
|---|---|---|
| ChEMBL: | CHEMBL124440 | |
| PubChem: | 7018 | |
| IUPAC: | 10H-anthracen-9-one | |
| Standard InChI: | InChI=1S/C14H10O/c15-14-12-7-3-1-5-10(12)9-11-6-2-4-8-13(11)14/h1-8H,9H2 | |
| Standard InChI Key: | RJGDLRCDCYRQOQ-UHFFFAOYSA-N | |
| SMILES: | O=C1c2ccccc2Cc2c1cccc2 | |
Molecular propeties
| ||
| AlogP: | 2.82 | |
|---|---|---|
| Hydrogen bonds acceptors: | 1 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 0 | |
| Number of rings: | 3 | |
| Molecular Weight: | 194.07 | |
| Topological polar surface area: | 17.1 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.071 | |
| Number of carbons: | 14 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
|---|