CHEMBL1182155
| SMILES | COc1cccc(OC)c1OCCNC[C@H]1COc2ccccc2O1 |
| InChIKey | GYSZUJHYXCZAKI-AWEZNQCLSA-N |
Chemical properties
| Hydrogen bond acceptors | 6 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 8 |
| Molecular weight (Da) | 345.2 |
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 |
| α2A | ADA2A | Rat | Adrenoceptors | A | pKd | 6.92 | 6.92 | 6.92 | ChEMBL |
| α1B | ADA1B | Rat | Adrenoceptors | A | pKd | 9.17 | 9.17 | 9.17 | ChEMBL |
| α1B | ADA1B | Human | Adrenoceptors | A | pKi | 8.24 | 8.24 | 8.24 | ChEMBL |
| α1A | ADA1A | Rat | Adrenoceptors | A | pKd | 9.49 | 9.73 | 9.98 | ChEMBL |
| α1D | ADA1D | Human | Adrenoceptors | A | pKi | 9.29 | 9.29 | 9.29 | ChEMBL |
| α1A | ADA1A | Human | Adrenoceptors | A | pKi | 9.39 | 9.39 | 9.39 | ChEMBL |
| 5-HT1A | 5HT1A | Rat | 5-Hydroxytryptamine | A | pKi | 8.61 | 8.61 | 8.61 | ChEMBL |
| 5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 8.61 | 8.61 | 8.61 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |