CHEMBL182770
SMILES | CC(C)=CCNc1cccc([C@@H](O)CN[C@H](C)Cc2c[nH]c3c(OS(C)(=O)=O)cccc23)c1 |
InChIKey | TZVFBJSCZAMNOI-JPYJTQIMSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 4 |
Rotatable bonds | 11 |
Molecular weight (Da) | 471.2 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
β3 | ADRB3 | Human | Adrenoceptors | A | pEC50 | 7.44 | 7.44 | 7.44 | ChEMBL |
β1 | ADRB1 | Human | Adrenoceptors | A | pEC50 | 6.8 | 7.12 | 7.44 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pEC50 | 6.8 | 7.12 | 7.44 | ChEMBL |