CHEMBL4093493
SMILES | O=C1COc2c(N3CCNCC3)ccc(O)c2N1 |
InChIKey | DXAXPAZZEGLINI-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 5 |
Hydrogen bond donors | 3 |
Rotatable bonds | 1 |
Molecular weight (Da) | 249.1 |
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 | 6.36 | 6.36 | 6.36 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 6.8 | 6.8 | 6.8 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.08 | 5.42 | 5.75 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |