CHEMBL608530
| SMILES | CN1CCCC[C@H]1CCN1c2ccccc2Sc2ccc([S+](C)[O-])cc21 |
| InChIKey | SLVMESMUVMCQIY-AJWVYOOVSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 4 |
| Molecular weight (Da) | 386.1 |
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-HT2C | 5HT2C | Rat | 5-Hydroxytryptamine | A | pKi | 6.15 | 6.27 | 6.39 | ChEMBL |
| D1 | DRD1 | Human | Dopamine | A | pKi | 5.71 | 5.96 | 6.21 | ChEMBL |
| D3 | DRD3 | Human | Dopamine | A | pKi | 6.71 | 6.87 | 7.02 | ChEMBL |
| 5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 6.4 | 6.43 | 6.46 | ChEMBL |
| D2 | DRD2 | Human | Dopamine | A | pKi | 6.37 | 6.45 | 6.52 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| D1 | DRD1 | Human | Dopamine | A | pIC50 | 5.9 | 5.9 | 5.9 | ChEMBL |
| D2 | DRD2 | Human | Dopamine | A | pIC50 | 5.93 | 6.0 | 6.08 | ChEMBL |