CHEMBL68720
SMILES | O=C(NCCCCCN1CCN(c2cccc(Cl)c2Cl)CC1)c1cccc2c1-c1ccccc1C2=O |
InChIKey | HTQLYZCPYPEYGO-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 521.2 |
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 | Rat | Dopamine | A | pKi | 8.7 | 8.7 | 8.7 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.28 | 6.28 | 6.28 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 7.55 | 7.55 | 7.55 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 8.3 | 8.3 | 8.3 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKi | 7.45 | 7.45 | 7.45 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |