CHEMBL36060
| SMILES | CC(C)(C)NC[C@H](O)COc1cccc2[nH]c(O)nc12 |
| InChIKey | UMQUQWCJKFOUGV-VIFPVBQESA-N |
Chemical properties
| Hydrogen bond acceptors | 5 |
| Hydrogen bond donors | 4 |
| Rotatable bonds | 5 |
| Molecular weight (Da) | 279.2 |
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 |
| β1 | ADRB1 | Human | Adrenoceptors | A | pKi | 9.6 | 9.6 | 9.6 | ChEMBL |
| β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 10.0 | 10.0 | 10.0 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| M1 | ACM1 | Rat | Acetylcholine (muscarinic) | A | Potency | 5.45 | 5.45 | 5.45 | ChEMBL |