RAFABEGRON
SMILES | C[C@H](Cc1c[nH]c2c(OCC(=O)O)cccc12)NC[C@H](O)c1cccc(Cl)c1 |
InChIKey | FHEYFIGWYQJVDR-ACJLOTCBSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 4 |
Rotatable bonds | 9 |
Molecular weight (Da) | 402.1 |
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 |
β3 | ADRB3 | Human | Adrenoceptors | A | pEC50 | 10.21 | 10.51 | 10.8 | ChEMBL |
β1 | ADRB1 | Human | Adrenoceptors | A | pEC50 | 8.19 | 8.19 | 8.19 | ChEMBL |
β2 | ADRB2 | Human | Adrenoceptors | A | pEC50 | 7.89 | 7.89 | 7.89 | ChEMBL |