CHEMBL250552
SMILES | CCCN(CCN1CCN(c2ccccc2)CC1)C1CCc2c(O)cccc2C1 |
InChIKey | ACDYFMOSSUKHJD-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 7 |
Molecular weight (Da) | 393.3 |
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 | 7.74 | 8.64 | 9.1 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.62 | 7.14 | 7.58 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D3 | DRD3 | Human | Dopamine | A | pEC50 | 9.92 | 9.92 | 9.92 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pEC50 | 8.65 | 8.65 | 8.65 | ChEMBL |