CHEMBL4226226
SMILES | CN(C)c1ccc(C(=O)NCCCCN2CCC(c3cccc(O)c3)C2)cc1 |
InChIKey | UVSNDTNJIHHUPU-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 8 |
Molecular weight (Da) | 381.2 |
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 |
D5 | DRD5 | Human | Dopamine | A | pKi | 6.02 | 6.26 | 6.51 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.87 | 7.07 | 7.27 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pKi | 5.34 | 5.71 | 6.08 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 7.57 | 7.76 | 7.87 | ChEMBL |
5-HT1A | 5HT1A | Human | 5-Hydroxytryptamine | A | pKi | 6.48 | 6.75 | 6.96 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.44 | 6.45 | 6.46 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |