CHEMBL57859
| SMILES | COc1ccccc1N1CCN(CCN2CCC3(CCCC3)CC2=O)CC1 |
| InChIKey | FEWRBUTUYATDFG-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 0 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 371.3 |
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 |
| α1D | ADA1D | Rat | Adrenoceptors | A | pKi | 9.43 | 9.43 | 9.43 | ChEMBL |
| α1B | ADA1B | Human | Adrenoceptors | A | pKi | 7.26 | 7.26 | 7.26 | ChEMBL |
| α1A | ADA1A | Rat | Adrenoceptors | A | pKi | 7.26 | 7.26 | 7.26 | ChEMBL |
| 5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 8.63 | 8.63 | 8.63 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |