CHEMBL2207642
| SMILES | COc1ccccc1N1CCN(Cc2cc(CN3CCN(c4ccc(Cl)cc4)CC3)c3cccccc2-3)CC1 |
| InChIKey | VDCBDIRJDJYCIZ-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 7 |
| Molecular weight (Da) | 540.3 |
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 | 5.8 | 5.8 | 5.8 | ChEMBL |
| D1 | DRD1 | Pig | Dopamine | A | pKi | 5.96 | 5.96 | 5.96 | ChEMBL |
| H2 | HRH2 | Human | Histamine | A | pKi | 6.34 | 6.34 | 6.34 | ChEMBL |
| H1 | HRH1 | Human | Histamine | A | pKi | 6.31 | 6.31 | 6.31 | ChEMBL |
| D4 | DRD4 | Human | Dopamine | A | pKi | 8.22 | 8.22 | 8.22 | ChEMBL |
| D3 | DRD3 | Human | Dopamine | A | pKi | 7.07 | 7.07 | 7.07 | ChEMBL |
| D2 | DRD2 | Human | Dopamine | A | pKi | 6.8 | 6.91 | 7.02 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |