CHEMBL521606
SMILES | CC(C)(C)NCC(O)COc1cccc2c1CC(O)C(O)C2 |
InChIKey | VWPOSFSPZNDTMJ-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 4 |
Rotatable bonds | 5 |
Molecular weight (Da) | 309.2 |
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 |
β2 | ADRB2 | Human | Adrenoceptors | A | pKd | 7.16 | 8.03 | 8.89 | ChEMBL |
β1 | ADRB1 | Human | Adrenoceptors | A | pKi | 8.16 | 8.16 | 8.16 | Drug Central |
β2 | ADRB2 | Human | Adrenoceptors | A | pKi | 8.07 | 8.07 | 8.07 | Drug Central |
β3 | ADRB3 | Human | Adrenoceptors | A | pKi | 8.2 | 8.2 | 8.2 | Drug Central |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |