CHEMBL127344
SMILES | COc1ccccc1N1CCN(CCCCNC(=O)c2cnc3ccccc3n2)CC1 |
InChIKey | PPJBKDPFCCVNFU-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 1 |
Rotatable bonds | 8 |
Molecular weight (Da) | 419.2 |
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 | 7.96 | 7.96 | 7.96 | ChEMBL |
D1 | DRD1 | Rat | Dopamine | A | pKi | 5.84 | 5.84 | 5.84 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKi | 7.08 | 7.08 | 7.08 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |