CHEMBL219185
SMILES | Cc1cccc(NC(=O)CN2CCC(c3cccc[n+]3[O-])CC2)c1 |
InChIKey | NJHQEWHCSIFEMP-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 325.2 |
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 | 6.53 | 6.53 | 6.53 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D4 | DRD4 | Rat | Dopamine | A | pEC50 | 7.24 | 7.24 | 7.24 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pEC50 | 7.5 | 7.5 | 7.5 | ChEMBL |