(-)-Cytisine
Representations & DB's id
| ||
| ChEBI: | None | |
|---|---|---|
| ChEMBL: | CHEMBL47039 | |
| PubChem: | 22407 | |
| IUPAC: | 7,11-diazatricyclo[7.3.1.02,7]trideca-2,4-dien-6-one | |
| Standard InChI: | InChI=1S/C11H14N2O/c14-11-3-1-2-10-9-4-8(5-12-6-9)7-13(10)11/h1-3,8-9,12H,4-7H2 | |
| Standard InChI Key: | ANJTVLIZGCUXLD-UHFFFAOYSA-N | |
| SMILES: | O=c1cccc2n1CC1CNCC2C1 | |
Molecular propeties
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| AlogP: | 0.55 | |
|---|---|---|
| Hydrogen bonds acceptors: | 3 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 0 | |
| Number of rings: | 3 | |
| Molecular Weight: | 190.11 | |
| Topological polar surface area: | 32.3 | |
| Number of aromatic rings: | 1 | |
| Fsp3: | 0.545 | |
| Number of carbons: | 11 | |
In vitro data
| Activity Type | Activity Value | Target Name | UniProt ID | Ref. |
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