CHEMBL3798018
SMILES | CN[C@@H]1Cc2cc(C#N)cc3[nH]c(=O)n(c23)C1 |
InChIKey | FXPWIJUEEVCPAI-SECBINFHSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 1 |
Molecular weight (Da) | 228.1 |
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 | Human | Dopamine | A | pKi | 4.57 | 4.57 | 4.57 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.29 | 5.29 | 5.29 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |