Ligand Data
Ligand
| Name | CHEMBL284912 |
| SMILES | CCCN(CCCCN1CCOCC1)C1COc2cccc(OC)c2C1 |
| InChIKey | LUDDDWQEQCANFX-UHFFFAOYSA-N |
| Type | small-molecule |
| External Links |
Structure
Properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 9 |
| Molecular weight | 362.3 |
Bioactivity
| Receptor | Affinity (nM) | Potency (nM) | ||||||||
|---|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Min | Avg | Max | Min | Avg | Max |
| 5-HT2A | 5HT2A | Bovine | 5-Hydroxytryptamine | A (Rhodopsin) | 10000 | 10000 | 10000 | |||
| α2A | ADA2A | Bovine | Adrenoceptors | A (Rhodopsin) | 4000 | 4000 | 4000 | |||
| α1A | ADA1A | Bovine | Adrenoceptors | A (Rhodopsin) | 10000 | 10000 | 10000 | |||
| D1 | DRD1 | Bovine | Dopamine | A (Rhodopsin) | 100000 | 100000 | 100000 | |||
| D2 | DRD2 | Bovine | Dopamine | A (Rhodopsin) | 30.0 | 30.0 | 30.0 | |||
| 5-HT1A | 5HT1A | Rat | 5-Hydroxytryptamine | A (Rhodopsin) | 4.0 | 6.0 | 8.0 | |||