CHEMBL218787
SMILES | Clc1ccc(N2CCN(Cc3cnn4c(I)cccc34)CC2)cc1 |
InChIKey | DQWYVTVADJXAAR-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 0 |
Rotatable bonds | 3 |
Molecular weight (Da) | 452.0 |
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 | 5.57 | 5.57 | 5.57 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.12 | 5.12 | 5.12 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 8.3 | 8.3 | 8.3 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |