CHEMBL599135
SMILES | CN1CCc2cc(Cl)c(O)cc2[C@H]2c3cccc(/C=N/OCc4ccccc4)c3CC[C@@H]21 |
InChIKey | YUNGHULYKDVTOC-JJQUOXMWSA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 1 |
Rotatable bonds | 4 |
Molecular weight (Da) | 446.2 |
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 |
D5 | DRD5 | Human | Dopamine | A | pKi | 8.6 | 8.6 | 8.6 | ChEMBL |
D4 | DRD4 | Human | Dopamine | A | pKi | 5.08 | 5.08 | 5.08 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pKi | 9.7 | 9.7 | 9.7 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 7.16 | 7.16 | 7.16 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |