CHEMBL322275
| SMILES | COc1cccc2c1CCCC2CCCN1CCN(c2ccccc2)CC1 |
| InChIKey | JGCUFOXBUYJGBX-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 3 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 6 |
| Molecular weight (Da) | 364.3 |
Drug properties
| Molecular type | Small molecule |
| Endogenous/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| 5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 9.3 | 9.3 | 9.3 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| 5-HT2A | 5HT2A | Rat | 5-Hydroxytryptamine | A | pIC50 | 6.64 | 6.64 | 6.64 | ChEMBL |
| α1A | ADA1A | Human | Adrenoceptors | A | pIC50 | 7.37 | 7.37 | 7.37 | ChEMBL |
| D2 | DRD2 | Rat | Dopamine | A | pIC50 | 6.96 | 6.97 | 7.01 | ChEMBL |
| 5-HT1A | 5HT1A | Rat | 5-Hydroxytryptamine | A | pIC50 | 9.3 | 9.34 | 9.44 | ChEMBL |