ABT-724
SMILES | c1ccc(N2CCN(Cc3nc4ccccc4[nH]3)CC2)nc1 |
InChIKey | FRPJGTNLZNXQEX-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 3 |
Molecular weight (Da) | 293.2 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Database connections
Ligand site mutations | D4 |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D4 | DRD4 | Human | Dopamine | A | pKi | 6.78 | 6.78 | 6.78 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 4.29 | 5.3 | 6.8 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D4 | DRD4 | Rat | Dopamine | A | pEC50 | 7.63 | 7.78 | 7.86 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pEC50 | 7.91 | 7.91 | 7.91 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pEC50 | 7.92 | 7.92 | 7.92 | ChEMBL |