CHEMBL35093
| SMILES | Cc1ccc(N2CCN(CC[C@H]3NC(=O)c4ccccc43)CC2)cc1C |
| InChIKey | WQEPZBNLBWDIRZ-OAQYLSRUSA-N |
Chemical properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 4 |
| Molecular weight (Da) | 349.2 |
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 | Bovine | 5-Hydroxytryptamine | A | pKi | 7.44 | 7.44 | 7.44 | ChEMBL |
| 5-HT1A | 5HT1A | Mouse | 5-Hydroxytryptamine | A | pKi | 6.28 | 6.28 | 6.28 | ChEMBL |
| α2A | ADA2A | Rat | Adrenoceptors | A | pKi | 6.9 | 6.9 | 6.9 | ChEMBL |
| A2B | AA2BR | Rat | Adenosine | A | pKi | 5.99 | 5.99 | 5.99 | ChEMBL |
| D4 | DRD4 | Human | Dopamine | A | pKi | 7.38 | 7.38 | 7.38 | ChEMBL |
| D2 | DRD2 | Human | Dopamine | A | pKi | 5.56 | 5.56 | 5.56 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |