CHEMBL447907
SMILES | COc1ccc(N2CCN(CCCCNC(=O)c3ccc4nonc4c3)CC2)cc1 |
InChIKey | DDFNIAVTIHLFOR-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 7 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 409.2 |
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 | 5.21 | 5.21 | 5.21 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 7.0 | 7.0 | 7.0 | PDSP Ki database |
D3 | DRD3 | Human | Dopamine | A | pKi | 5.21 | 5.21 | 5.21 | PDSP Ki database |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |