CHEMBL84557
SMILES | C=CCN(C)C[C@@H]1OC(C2CCCCC2)Cc2c1ccc(O)c2O |
InChIKey | JJNYVWDKXCESON-GGYWPGCISA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 2 |
Rotatable bonds | 5 |
Molecular weight (Da) | 331.2 |
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 |
D1 | DRD1 | Rat | Dopamine | A | pKi | 5.5 | 5.5 | 5.5 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKi | 5.58 | 5.58 | 5.58 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D1 | DRD1 | Human | Dopamine | A | pEC50 | 6.19 | 6.19 | 6.19 | ChEMBL |