CHEMBL1928124
SMILES | CCOCCOCc1ccc(C(=O)NCCCCN2CCN(c3ccccc3OC)CC2)cc1 |
InChIKey | CTWFQXKVAMVTEI-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 14 |
Molecular weight (Da) | 469.3 |
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 |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.54 | 6.81 | 7.08 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 7.8 | 7.8 | 7.8 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.6 | 6.6 | 6.6 | ChEMBL |
D1 | DRD1 | Pig | Dopamine | A | pKi | 5.44 | 5.44 | 5.44 | ChEMBL |
α1A | Q9TSW7 | Pig | Adrenoceptors | A | pKi | 8.05 | 8.05 | 8.05 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |