CHEMBL1278085
SMILES | C[C@H](Oc1ccccc1-c1cccc(O)c1)C1=NCCN1 |
InChIKey | XGMNRALXOWECNG-LBPRGKRZSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 4 |
Molecular weight (Da) | 282.1 |
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 | 6.0 | 6.0 | 6.0 | ChEMBL |
α2C | ADA2C | Human | Adrenoceptors | A | pKi | 6.95 | 6.95 | 6.95 | ChEMBL |
α2A | ADA2A | Human | Adrenoceptors | A | pKi | 7.01 | 7.01 | 7.01 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
α2C | ADA2C | Human | Adrenoceptors | A | pEC50 | 5.6 | 5.6 | 5.6 | ChEMBL |