CHEMBL3741079
SMILES | O=C1c2ccccc2C(=O)N1Cc1ccc(CCN2CCN(c3ccc(Br)cc3)CC2)cc1 |
InChIKey | QTCOOXCCPGHCLB-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 0 |
Rotatable bonds | 6 |
Molecular weight (Da) | 503.1 |
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 |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
α1B | ADA1B | Human | Adrenoceptors | A | pIC50 | 6.0 | 6.0 | 6.0 | ChEMBL |
α1A | ADA1A | Human | Adrenoceptors | A | pIC50 | 5.47 | 5.47 | 5.47 | ChEMBL |
α1D | ADA1D | Human | Adrenoceptors | A | pIC50 | 5.13 | 5.13 | 5.13 | ChEMBL |