CHEMBL362763
SMILES | C[C@H](Cc1c[nH]c2c(OS(=O)(=O)c3ccc(C(=O)O)cc3)cccc12)NC[C@H](O)c1cccc(NS(=O)(=O)c2cccs2)c1 |
InChIKey | BSGXQRKXXHVKLG-BCHFMIIMSA-N |
Chemical properties
Hydrogen bond acceptors | 9 |
Hydrogen bond donors | 5 |
Rotatable bonds | 13 |
Molecular weight (Da) | 655.1 |
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 | 8.96 | 8.96 | 8.96 | ChEMBL |
β1 | ADRB1 | Human | Adrenoceptors | A | pEC50 | 7.07 | 7.07 | 7.07 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pEC50 | 7.22 | 7.22 | 7.22 | ChEMBL |