Flavanthridin
Representations & DB's id
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| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL1082453 | |
| PubChem: | 14777891 | |
| IUPAC: | 5,7-dimethoxy-9,10-dihydrophenanthrene-2,6-diol | |
| Standard InChI: | InChI=1S/C16H16O4/c1-19-13-8-10-4-3-9-7-11(17)5-6-12(9)14(10)16(20-2)15(13)18/h5-8,17-18H,3-4H2,1-2H3 | |
| Standard InChI Key: | SOHTUOALNFQEMJ-UHFFFAOYSA-N | |
| SMILES: | COc1c(O)c(OC)cc2c1c1ccc(cc1CC2)O | |
Molecular propeties
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| AlogP: | 2.88 | |
|---|---|---|
| Hydrogen bonds acceptors: | 4 | |
| Hydrogen bonds donors: | 2 | |
| Rotatable bonds: | 2 | |
| Number of rings: | 3 | |
| Molecular Weight: | 272.1 | |
| Topological polar surface area: | 58.9 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.25 | |
| Number of carbons: | 16 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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