CHEMBL522151
| SMILES | c1ccc(-c2cccc3c2OC(C2=NCCN2)CO3)cc1 |
| InChIKey | LOGUSYSMQQMCJG-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 4 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 2 |
| Molecular weight (Da) | 280.1 |
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 |
| α2B | ADA2B | Human | Adrenoceptors | A | pKi | 6.32 | 6.32 | 6.32 | ChEMBL |
| α2C | ADA2C | Human | Adrenoceptors | A | pKi | 6.16 | 6.16 | 6.16 | ChEMBL |
| α2A | ADA2A | Human | Adrenoceptors | A | pKi | 6.62 | 6.62 | 6.62 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| α2B | ADA2B | Human | Adrenoceptors | A | pEC50 | 4.65 | 4.65 | 4.65 | ChEMBL |
| α2C | ADA2C | Human | Adrenoceptors | A | pEC50 | 5.5 | 5.5 | 5.5 | ChEMBL |