CHEMBL431220
SMILES | CCCCC1Cc2c(ccc(O)c2O)[C@H](CN)O1 |
InChIKey | MMVLDBWARAYRHY-NCWAPJAISA-N |
Chemical properties
Hydrogen bond acceptors | 4 |
Hydrogen bond donors | 3 |
Rotatable bonds | 4 |
Molecular weight (Da) | 251.2 |
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 | 6.06 | 6.06 | 6.06 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKi | 6.08 | 6.08 | 6.08 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D2 | DRD2 | Rat | Dopamine | A | pEC50 | 6.45 | 6.45 | 6.45 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pEC50 | 8.2 | 8.2 | 8.2 | ChEMBL |