CHEMBL4248093
SMILES | CCc1ccccc1OC[C@@H](O)CNCCc1ccc(NS(=O)(=O)c2ccccc2)cc1 |
InChIKey | LQEFSEHVLBMJEI-QHCPKHFHSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 3 |
Rotatable bonds | 12 |
Molecular weight (Da) | 454.2 |
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 | 7.95 | 7.95 | 7.95 | ChEMBL |
β1 | ADRB1 | Human | Adrenoceptors | A | pEC50 | 6.53 | 6.53 | 6.53 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pEC50 | 6.02 | 6.02 | 6.02 | ChEMBL |