CHEMBL1956906
SMILES | c1ccc(C2(c3ccccc3)COCC(C3=NCCN3)O2)cc1 |
InChIKey | VMIZIRROPNWIIU-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 308.2 |
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 |
α2B | ADA2B | Human | Adrenoceptors | A | pKi | 5.35 | 5.35 | 5.35 | ChEMBL |
α2C | ADA2C | Human | Adrenoceptors | A | pKi | 5.21 | 5.21 | 5.21 | ChEMBL |
α2A | ADA2A | Human | Adrenoceptors | A | pKi | 5.42 | 5.42 | 5.42 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |