CHEMBL289248
SMILES | CS(=O)(=O)NC(c1ccc(F)cc1)c1nc(-c2ccc(S(=O)(=O)Nc3ccc(CCNC[C@H](O)c4cccnc4)cc3)cc2)no1 |
InChIKey | RZSMMDOVVPJVHW-XLTVJXRZSA-N |
Chemical properties
Hydrogen bond acceptors | 10 |
Hydrogen bond donors | 4 |
Rotatable bonds | 14 |
Molecular weight (Da) | 666.2 |
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 | 7.96 | 7.96 | 7.96 | ChEMBL |
β1 | ADRB1 | Human | Adrenoceptors | A | pIC50 | 5.16 | 5.16 | 5.16 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pIC50 | 5.6 | 5.6 | 5.6 | ChEMBL |