CHEMBL13079
SMILES | O=S(=O)(Cc1ccccc1)Nc1ccc(CCNC[C@H](O)COc2ccc(O)cc2)cc1 |
InChIKey | CXCLGAYJHZTVLS-QHCPKHFHSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 4 |
Rotatable bonds | 12 |
Molecular weight (Da) | 456.2 |
Drug properties
Molecular type | Small molecule |
Endogenous/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 | 7.41 | 7.41 | 7.41 | ChEMBL |
β1 | ADRB1 | Human | Adrenoceptors | A | pIC50 | 7.22 | 7.22 | 7.22 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pIC50 | 7.68 | 7.68 | 7.68 | ChEMBL |