CHEMBL160296
SMILES | COc1ccccc1N1CCN(CCCCOc2ccc3c(c2)NC(=O)CC3)CC1 |
InChIKey | HVSUPPZVIPTMEM-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 409.2 |
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 |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.67 | 6.67 | 6.67 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 7.88 | 7.88 | 7.88 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 9.49 | 9.56 | 9.66 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D2 | DRD2 | Human | Dopamine | A | pEC50 | 8.6 | 9.04 | 9.3 | ChEMBL |