CHEMBL3415019
SMILES | COc1ccccc1N1CCN(CCCNC(=O)c2cn(C)c3ccccc23)CC1 |
InChIKey | ZAQWTEPNQWYHIK-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 7 |
Molecular weight (Da) | 406.2 |
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 |
α1B | ADA1B | Rat | Adrenoceptors | A | pKd | 6.78 | 6.78 | 6.78 | ChEMBL |
α1A | ADA1A | Rat | Adrenoceptors | A | pKd | 7.28 | 7.28 | 7.28 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |