CHEMBL1257883
SMILES | CN1C(=O)N(CC(O)CN2CCN(c3ccccc3F)CC2)C(c2ccccc2)(c2ccccc2)C1=O |
InChIKey | ZTMOGXXMLUCQMX-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 7 |
Molecular weight (Da) | 502.2 |
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 |
α1D | ADA1D | Rat | Adrenoceptors | A | pKd | 6.61 | 6.61 | 6.61 | ChEMBL |
α1B | ADA1B | Human | Adrenoceptors | A | pKd | 5.74 | 5.74 | 5.74 | ChEMBL |
α1A | ADA1A | Rat | Adrenoceptors | A | pKd | 6.05 | 6.05 | 6.05 | ChEMBL |
α1A | ADA1A | Rat | Adrenoceptors | A | pKi | 6.25 | 6.25 | 6.25 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |