1-(4-Methoxyphenyl)Propan-1-One
Representations & DB's id
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| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL444556 | |
| PubChem: | 67144 | |
| IUPAC: | 1-(4-methoxyphenyl)propan-1-one | |
| Standard InChI: | InChI=1S/C10H12O2/c1-3-10(11)8-4-6-9(12-2)7-5-8/h4-7H,3H2,1-2H3 | |
| Standard InChI Key: | ZJVAWPKTWVFKHG-UHFFFAOYSA-N | |
| SMILES: | CCC(=O)c1ccc(cc1)OC | |
Molecular propeties
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| AlogP: | 2.29 | |
|---|---|---|
| Hydrogen bonds acceptors: | 2 | |
| Hydrogen bonds donors: | 0 | |
| Rotatable bonds: | 3 | |
| Number of rings: | 1 | |
| Molecular Weight: | 164.08 | |
| Topological polar surface area: | 26.3 | |
| Number of aromatic rings: | 1 | |
| Fsp3: | 0.3 | |
| Number of carbons: | 10 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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