Davidigenin
Representations & DB's id
| ||
| ChEBI: | CHEBI:27655 | |
|---|---|---|
| ChEMBL: | CHEMBL192877 | |
| PubChem: | 442342 | |
| IUPAC: | 1-(2,4-dihydroxyphenyl)-3-(4-hydroxyphenyl)propan-1-one | |
| Standard InChI: | InChI=1S/C15H14O4/c16-11-4-1-10(2-5-11)3-8-14(18)13-7-6-12(17)9-15(13)19/h1-2,4-7,9,16-17,19H,3,8H2 | |
| Standard InChI Key: | UDGKKUWYNITJRX-UHFFFAOYSA-N | |
| SMILES: | Oc1ccc(cc1)CCC(=O)c1ccc(cc1O)O | |
Molecular propeties
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| AlogP: | 2.62 | |
|---|---|---|
| Hydrogen bonds acceptors: | 4 | |
| Hydrogen bonds donors: | 3 | |
| Rotatable bonds: | 4 | |
| Number of rings: | 2 | |
| Molecular Weight: | 258.09 | |
| Topological polar surface area: | 77.8 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.133 | |
| Number of carbons: | 15 | |