CHEMBL523265
SMILES | CC(C)Oc1ccc(Oc2cccc(CCNC[C@H](O)c3cccc(Cl)c3)c2)cc1C(=O)O |
InChIKey | KRDKLBROXABSCR-DEOSSOPVSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 3 |
Rotatable bonds | 11 |
Molecular weight (Da) | 469.2 |
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 | Dog | Adrenoceptors | A | pEC50 | 8.49 | 8.49 | 8.49 | ChEMBL |
β3 | ADRB3 | Human | Adrenoceptors | A | pEC50 | 8.47 | 8.47 | 8.47 | ChEMBL |
β1 | ADRB1 | Human | Adrenoceptors | A | pEC50 | 6.09 | 6.09 | 6.09 | ChEMBL |