CHEMBL4102646
SMILES | CN1CCN(c2ccc(O)c3c2OCC(=O)N3)CC1 |
InChIKey | MZFAZCYLMYZDDU-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 2 |
Rotatable bonds | 1 |
Molecular weight (Da) | 263.1 |
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 | 7.23 | 7.23 | 7.23 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 7.32 | 7.32 | 7.32 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.2 | 6.45 | 6.7 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D2 | DRD2 | Human | Dopamine | A | pEC50 | 6.52 | 6.52 | 6.52 | ChEMBL |