CHEMBL69571
SMILES | O=C(NC/C=C/CN1CCN(c2cccc(Cl)c2Cl)CC1)c1cccc2c1-c1ccccc1C2 |
InChIKey | LFQZHAKGDXWDRR-ONEGZZNKSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 6 |
Molecular weight (Da) | 491.2 |
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 |
D3 | DRD3 | Rat | Dopamine | A | pKi | 7.72 | 7.72 | 7.72 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKi | 6.97 | 6.97 | 6.97 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.44 | 6.44 | 6.44 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 7.19 | 7.64 | 8.09 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 7.2 | 7.2 | 7.2 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D3 | DRD3 | Human | Dopamine | A | pIC50 | 6.94 | 6.94 | 6.94 | ChEMBL |