CHEMBL3350265
SMILES | CS(=O)(=O)Nc1cccc2c1CCC=C2c1c[nH]cn1 |
InChIKey | JIJRXPOQLAUOTO-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 3 |
Molecular weight (Da) | 289.1 |
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 |
α1B | ADA1B | Golden hamster | Adrenoceptors | A | pKi | 4.98 | 4.98 | 4.98 | ChEMBL |
α1D | ADA1D | Rat | Adrenoceptors | A | pKi | 5.67 | 5.72 | 5.77 | ChEMBL |
α1A | ADA1A | Rat | Adrenoceptors | A | pKi | 5.94 | 6.01 | 6.08 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |