| Trade Names | |
| Synonyms | |
| Status | |
| Molecule Category | Salt-form |
| UNII | 7L3E358N9L |
| EPA CompTox | DTXSID7020550 |
| Parent Compound: | DOPAMINE |
| InChI Key | CTENFNNZBMHDDG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C8H12ClNO2 |
| Molecular Weight | 189.64 |
| AlogP | 0.6 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 66.48 |
| Molecular species | BASE |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 11.0 |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Membrane receptor
Family A G protein-coupled receptor
Small molecule receptor (family A GPCR)
Monoamine receptor
Dopamine receptor
|
0.631-37 | - | - | 2-920 | - | |
|
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 66.46-73.49 |
|
Protein: Beta-1 adrenergic receptor Description: Beta-1 adrenergic receptor Organism : Homo sapiens P08588 ENSG00000043591 |
||||
| Resources | Reference |
|---|---|
| ChEBI | 4698 |
| ChEMBL | CHEMBL1557 |
| FDA SRS | 7L3E358N9L |
| Guide to Pharmacology | 940 |
| KEGG | C03758 |
| PDB | LDP |
| PubChem | 65340 |
| SureChEMBL | SCHEMBL40951 |
| ZINC | ZINC00033882 |