CHEMBL1180629
SMILES | Oc1ccc2c(c1)OC(CNCc1ccccc1)CC2 |
InChIKey | DWUAAOIZQFTYQP-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 4 |
Molecular weight (Da) | 269.1 |
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 | 8.08 | 8.89 | 9.7 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.72 | 6.72 | 6.72 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 8.08 | 8.08 | 8.08 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 8.01 | 8.01 | 8.01 | ChEMBL |
5-HT1A | 5HT1A | Rat | 5-Hydroxytryptamine | A | pKi | 7.28 | 7.28 | 7.28 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |