CHEMBL13560
SMILES | C[C@@H](NCCc1ccc(OCC(=O)O)c(Cl)c1)[C@@H](O)c1ccc(O)cc1 |
InChIKey | YNCNZXJRRRALAJ-CWTRNNRKSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 4 |
Rotatable bonds | 9 |
Molecular weight (Da) | 379.1 |
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 |
β2 | ADRB2 | Rat | Adrenoceptors | A | pIC50 | 5.19 | 5.19 | 5.19 | ChEMBL |
β2 | ADRB2 | Dog | Adrenoceptors | A | pIC50 | 5.19 | 5.19 | 5.19 | ChEMBL |
β3 | ADRB3 | Human | Adrenoceptors | A | pEC50 | 8.42 | 8.42 | 8.42 | ChEMBL |