CHEMBL5272162
SMILES | OCc1[nH]c2ccccc2c1CN1CCN(c2ccccc2)CC1 |
InChIKey | RTNHENHQSIAEAI-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 4 |
Molecular weight (Da) | 321.2 |
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 | 9.18 | 9.18 | 9.18 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 5.48 | 5.48 | 5.48 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.68 | 5.68 | 5.68 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |