CHEMBL97760
SMILES | Oc1cc(-c2ccccc2)nc2nc(Cl)ccc12 |
InChIKey | JSCUNIPKMPNPFX-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 1 |
Molecular weight (Da) | 256.0 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
A3 | AA3R | Rat | Adenosine | A | pKi | 5.68 | 5.68 | 5.68 | ChEMBL |
A1 | AA1R | Bovine | Adenosine | A | pKi | 8.79 | 9.48 | 9.82 | ChEMBL |
A2A | AA2AR | Human | Adenosine | A | pKi | 6.35 | 6.78 | 7.0 | ChEMBL |
A1 | AA1R | Human | Adenosine | A | pKi | 6.17 | 7.5 | 9.8 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
TSH | TSHR | Human | Glycoprotein hormone | A | Potency | 5.5 | 5.5 | 5.5 | ChEMBL |