CHEMBL303339
| SMILES | CN(C)[C@@H]1CCc2ccc3[nH]ccc3c2C1 |
| InChIKey | HENBLLXAHPTGHX-LLVKDONJSA-N |
Chemical properties
| Hydrogen bond acceptors | 1 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 1 |
| Molecular weight (Da) | 214.1 |
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-HT1B | 5HT1B | Human | 5-Hydroxytryptamine | A | pKi | 6.64 | 6.64 | 6.64 | ChEMBL |
| 5-HT1D | 5HT1D | Human | 5-Hydroxytryptamine | A | pKi | 7.82 | 7.82 | 7.82 | ChEMBL |
| D2 | DRD2 | Rat | Dopamine | A | pKi | 6.77 | 7.29 | 7.82 | ChEMBL |
| 5-HT1A | 5HT1A | Rat | 5-Hydroxytryptamine | A | pKi | 7.6 | 7.71 | 7.82 | ChEMBL |
| D3 | DRD3 | Rat | Dopamine | A | pKi | 6.57 | 6.57 | 6.57 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| D1 | DRD1 | Rat | Dopamine | A | pIC50 | 4.69 | 4.69 | 4.69 | ChEMBL |
| D2 | DRD2 | Rat | Dopamine | A | pIC50 | 5.98 | 5.98 | 5.98 | ChEMBL |
| 5-HT1A | 5HT1A | Rat | 5-Hydroxytryptamine | A | pIC50 | 7.51 | 7.51 | 7.51 | ChEMBL |