(R)-SKF-38393
SMILES | Oc1cc2c(cc1O)[C@@H](c1ccccc1)CNCC2 |
InChIKey | JUDKOGFHZYMDMF-CQSZACIVSA-N |
Chemical properties
Hydrogen bond acceptors | 3 |
Hydrogen bond donors | 3 |
Rotatable bonds | 1 |
Molecular weight (Da) | 255.1 |
Drug properties
Molecular type | Small molecule |
Physiological/Surrogate | Surrogate |
Approved drug | No |
Bioactivities
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D5 | DRD5 | Human | Dopamine | A | pKi | 6.61 | 7.51 | 9.3 | ChEMBL |
D1 | DRD1 | Rat | Dopamine | A | pKi | 7.19 | 7.28 | 7.46 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pKi | 5.16 | 5.29 | 5.54 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pKi | 6.5 | 7.52 | 9.0 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pKd | 6.82 | 6.82 | 6.82 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKi | 5.02 | 5.18 | 5.33 | ChEMBL |
D2 | DRD2 | Human | Dopamine | A | pKd | 5.02 | 5.02 | 5.02 | ChEMBL |
Receptor | Activity | Source | |||||||
---|---|---|---|---|---|---|---|---|---|
GTP | Uniprot | Species | Family | Class | Type | Min | Avg | Max | Database |
D1 | DRD1 | Goldfish | Dopamine | A | pEC50 | 6.02 | 6.02 | 6.02 | ChEMBL |
D1 | DRD1 | Rat | Dopamine | A | pEC50 | 7.0 | 7.0 | 7.0 | ChEMBL |
D1 | DRD1 | Rat | Dopamine | A | pIC50 | 7.3 | 7.38 | 7.46 | ChEMBL |
D2 | DRD2 | Rat | Dopamine | A | pIC50 | 5.43 | 5.43 | 5.43 | ChEMBL |
D1 | DRD1 | Human | Dopamine | A | pEC50 | 6.41 | 7.1 | 7.52 | ChEMBL |