RX 811033
| SMILES | CCOC1(COC2=CC=CC=C2O1)C3=NCCN3 |
| InChIKey | PXTLRBYNGGDZBN-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 3 |
| Molecular weight (Da) | 248.1 |
Drug properties
| Molecular type | Small molecule |
| Physiological/Surrogate | Surrogate |
| Approved drug | No |
Database connections
| Ligand site mutations | α2A |
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| α2A | ADA2A | Human | Adrenoceptors | A | pKi | 9.7 | 9.7 | 9.7 | PDSP Ki database |
| α2C | ADA2C | Human | Adrenoceptors | A | pKi | 9.62 | 9.62 | 9.62 | PDSP Ki database |
| α2B | ADA2B | Rat | Adrenoceptors | A | pKi | 9.24 | 9.24 | 9.24 | PDSP Ki database |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |