CHEMBL3084510
SMILES | COc1ccc2[nH]cc(CN3[C@H]4CC[C@@H]3C[C@@](O)(c3ccc(Cl)cc3)C4)c2c1 |
InChIKey | HFZAKKDYDONOQJ-MOJGAOKDSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 2 |
Rotatable bonds | 4 |
Molecular weight (Da) | 396.2 |
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 |
D3 | DRD3 | Human | Dopamine | A | pKi | 7.67 | 7.67 | 7.67 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 7.41 | 7.41 | 7.41 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |