CHEMBL218203
SMILES | O=C(NCCCCN1CCN(c2ccccc2Cl)CC1)c1ccc2ccccc2c1 |
InChIKey | NORQFMPKBRSFFC-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 7 |
Molecular weight (Da) | 421.2 |
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 |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.7 | 6.7 | 6.7 | ChEMBL |
α1A | ADA1A | Human | Adrenoceptors | A | pKi | 7.52 | 7.52 | 7.52 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 9.0 | 9.07 | 9.15 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.34 | 6.48 | 6.62 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |