CHEMBL1852744
SMILES | O=C1NC(=O)N(Cc2cccc(CCCCOCCCCCCNC[C@H](O)c3ccc(O)c(CO)c3)c2)C1=O |
InChIKey | MKLXSINHBJIRJU-SANMLTNESA-N |
Chemical properties
Hydrogen bond acceptors | 8 |
Hydrogen bond donors | 5 |
Rotatable bonds | 18 |
Molecular weight (Da) | 541.3 |
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 | 7.6 | 7.6 | 7.6 | ChEMBL |
β1 | ADRB1 | Human | Adrenoceptors | A | pEC50 | 7.3 | 7.3 | 7.3 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pEC50 | 9.1 | 9.1 | 9.1 | ChEMBL |