CHEMBL3287390
SMILES | Clc1cccc(N2CCN(CCCCOc3ccn4nccc4c3)CC2)c1Cl |
InChIKey | QNWQLJBICCQPMP-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 0 |
Rotatable bonds | 7 |
Molecular weight (Da) | 418.1 |
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 | 6.89 | 6.89 | 6.89 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 8.15 | 8.15 | 8.15 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 7.41 | 7.44 | 7.47 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D3 | DRD3 | Human | Dopamine | A | pEC50 | 7.18 | 7.18 | 7.18 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pEC50 | 6.75 | 6.75 | 6.75 | ChEMBL |