CHEMBL75604
SMILES | CCCCCCNC(=O)Nc1ccc(S(=O)(=O)Nc2ccc(-c3ccc(CC4NCCc5cc(O)c(O)cc54)cc3)cc2)cc1 |
InChIKey | GNEIFZWDMCOTFS-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 6 |
Rotatable bonds | 12 |
Molecular weight (Da) | 628.3 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Sankey plot
Compound is not listed as a drug.
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 | 8.22 | 8.22 | 8.22 | ChEMBL |
β1 | ADRB1 | Human | Adrenoceptors | A | pIC50 | 5.52 | 5.52 | 5.52 | ChEMBL |
β1 | ADRB1 | Human | Adrenoceptors | A | pEC50 | 5.75 | 5.75 | 5.75 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pIC50 | 5.47 | 5.47 | 5.47 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pEC50 | 6.47 | 6.47 | 6.47 | ChEMBL |