CHEMBL238917
SMILES | COc1ccccc1N1CCN(CCCCN2C(=O)c3ccccc3S2(=O)=O)CC1 |
InChIKey | QMIUZKMFRCDUKI-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 0 |
Rotatable bonds | 7 |
Molecular weight (Da) | 429.2 |
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 |
D5 | DRD5 | Human | Dopamine | A | pKi | 5.95 | 5.95 | 5.95 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 7.1 | 7.1 | 7.1 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 6.73 | 6.73 | 6.73 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.44 | 7.03 | 8.21 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |