A-794282
SMILES | CCc1ccc(cc1)n1cnc2c(c1=O)sc1c2c(ccn1)N(C)C |
InChIKey | VCUKKMIXURRDKL-UHFFFAOYSA-N |
Chemical properties
Hydrogen bond acceptors | 6 |
Hydrogen bond donors | 0 |
Rotatable bonds | 3 |
Molecular weight (Da) | 350.1 |
Drug properties
Molecular type | Small molecule |
Endogenous/Surrogate | Surrogate |
Approved drug | No |
Database connections
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D2 | DRD2 | Rat | Dopamine | A | pKi | 9.19 | 9.19 | 9.19 | ChEMBL |
D3 | DRD3 | Human | Dopamine | A | pKi | 9.6 | 9.6 | 9.6 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 6.6 | 6.6 | 6.6 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |