CHEMBL3800165
SMILES | CCCN[C@@H]1Cc2cccc3c2n(c(=O)n3CCC)C1 |
InChIKey | FHJKGVBVLIXGIQ-CYBMUJFWSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 5 |
Molecular weight (Da) | 273.2 |
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 |
D3 | DRD3 | Human | Dopamine | A | pKi | 7.32 | 7.49 | 7.66 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.06 | 7.07 | 8.09 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D3 | DRD3 | Human | Dopamine | A | pEC50 | 5.85 | 6.55 | 7.25 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pEC50 | 7.17 | 7.53 | 7.89 | ChEMBL |