CHEMBL2058631
SMILES | CC1CNC(Nc2c(Cl)cccc2Cl)=N1 |
InChIKey | ITKQNORKNISIMB-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 1 |
Molecular weight (Da) | 243.0 |
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 | 5.88 | 5.88 | 5.88 | ChEMBL |
α2C | ADA2C | Human | Adrenoceptors | A | pKi | 5.24 | 5.24 | 5.24 | ChEMBL |
α2A | ADA2A | Human | Adrenoceptors | A | pKi | 5.71 | 5.71 | 5.71 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |