CHEMBL329398
SMILES | Oc1nc2c(OCCNCc3ccccc3)cc(Cl)cc2[nH]1 |
InChIKey | YKNNRQLCQGQFRB-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 3 |
Rotatable bonds | 6 |
Molecular weight (Da) | 317.1 |
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 |
D2 | DRD2 | Rat | Dopamine | A | pKi | 8.57 | 9.09 | 9.6 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 8.59 | 8.59 | 8.59 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 8.13 | 8.13 | 8.13 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 7.8 | 7.8 | 7.8 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |