CHEMBL1256414
SMILES | c1ccc2c(c1)C[C@]1(c3c[nH]cn3)C[C@H]21 |
InChIKey | FIERHAFMRVRMDV-YPMHNXCESA-N |
Chemical properties
Hydrogen bond acceptors | 1 |
Hydrogen bond donors | 1 |
Rotatable bonds | 1 |
Molecular weight (Da) | 196.1 |
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 |
α2B | ADA2B | Human | Adrenoceptors | A | pKi | 9.56 | 9.82 | 9.96 | ChEMBL |
α2C | ADA2C | Human | Adrenoceptors | A | pKi | 9.58 | 9.74 | 9.89 | ChEMBL |
α2A | ADA2A | Human | Adrenoceptors | A | pKi | 10.1 | 10.27 | 10.55 | ChEMBL |
α1B | ADA1B | Human | Adrenoceptors | A | pKi | 8.45 | 8.77 | 8.98 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |