CHEMBL298763
SMILES | O=C(NCN1CCN(c2ccccc2Cl)CC1)c1ccccc1 |
InChIKey | NZCZNMGSFLEVRM-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 329.1 |
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 |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.97 | 7.32 | 7.5 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 6.75 | 6.75 | 6.75 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.82 | 6.29 | 6.75 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D4 | DRD4 | Human | Dopamine | A | pEC50 | 6.97 | 6.97 | 6.97 | ChEMBL |