CHEMBL2207641
| SMILES | COc1ccccc1N1CCN(Cc2cc(CN3CCN(c4ccccc4OC)CC3)c3cccccc2-3)CC1 |
| InChIKey | HVGNYVOUQOKFLU-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 8 |
| Molecular weight (Da) | 536.3 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| 5-HT2A | 5HT2A | Pig | 5-Hydroxytryptamine | A | pKi | 6.25 | 6.25 | 6.25 | ChEMBL |
| D1 | DRD1 | Pig | Dopamine | A | pKi | 6.13 | 6.13 | 6.13 | ChEMBL |
| H2 | HRH2 | Human | Histamine | A | pKi | 6.28 | 6.28 | 6.28 | ChEMBL |
| H1 | HRH1 | Human | Histamine | A | pKi | 6.0 | 6.0 | 6.0 | ChEMBL |
| D4 | DRD4 | Human | Dopamine | A | pKi | 9.1 | 9.1 | 9.1 | ChEMBL |
| D3 | DRD3 | Human | Dopamine | A | pKi | 7.48 | 7.48 | 7.48 | ChEMBL |
| D2 | DRD2 | Human | Dopamine | A | pKi | 7.47 | 7.62 | 7.77 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |