CHEMBL573792
| SMILES | O=C(NCCCCN1CCN(c2cccc(Cl)c2Cl)CC1)c1cn(-c2ccc([N+](=O)[O-])cc2)nn1 |
| InChIKey | FFDHLEGSHFJYQA-UHFFFAOYSA-N |
Chemical properties
| Hydrogen bond acceptors | 8 |
| Hydrogen bond donors | 1 |
| Rotatable bonds | 9 |
| Molecular weight (Da) | 517.1 |
Drug properties
| Molecular type | Small molecule |
| Endogenous/Surrogate | Surrogate |
| Approved drug | No |
Database connections
Bioactivities
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
| D1 | DRD1 | Pig | Dopamine | A | pKi | 6.12 | 6.12 | 6.12 | ChEMBL |
| D4 | DRD4 | Human | Dopamine | A | pKi | 8.24 | 8.24 | 8.24 | ChEMBL |
| D3 | DRD3 | Human | Dopamine | A | pKi | 6.5 | 6.5 | 6.5 | ChEMBL |
| D2 | DRD2 | Human | Dopamine | A | pKi | 6.09 | 6.93 | 7.77 | ChEMBL |
| Receptor | Activity | Source | |||||||
|---|---|---|---|---|---|---|---|---|---|
| GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |