Basic Information
| Drug ID | DDPD00988 |
|
| Drug Name | Dopamine | |
| Molecular Weight | 153.1784 | |
| Molecular Formula | C8H11NO2 | |
| CAS Number | 51-61-6 | |
| SMILES | NCCC1=CC(O)=C(O)C=C1 | |
| External Links | ||
| DRUGBANK | DB00988 | |
| T3DB | T3D4300 | |
| PubChem Compound | 681 | |
| Drugs.com | Drugs.com Drug Page | |
Experimental Physicochemical Property
| Property Name | Property Value | Unit | Raw Value | Raw Unit | Reference |
|---|---|---|---|---|---|
| Caco-2 Permeability | -5.03 | - | -5.03 | - | ADME Research, USCD |
| Log P | -0.98 | - | -0.98 | - | HANSCH,C ET AL. (1995) |
| Boiling Point | 227.0 | ℃ | 227 | ℃ | PhysProp |
| Melting Point | 128.0 | ℃ | 128 | ℃ | PhysProp |
| Water Solubility | 600000.0 | mg/L | 600 | g/L | DRUGBANK |
| pKa | 8.93 | - | 8.93 | - | PERRIN,DD (1965) |
Pharmacokinetic/ Toxicokinetic Property
| Property Name | Property Value | Unit | Raw Value | Raw Unit | Annotation | Reference |
|---|---|---|---|---|---|---|
| Clearance | 4.0 | L/h/kg | 65.9 | ml/min/kg | intravenous injection, IV; human, homo sapiens; | Human Intravenous Pharmacokinetic Dataset |
| Volume of Distribution | 0.74 | L/kg | 0.74 | L/kg | intravenous injection, IV; human, homo sapiens; | Human Intravenous Pharmacokinetic Dataset |
| Half-life | 0.0333 | h | 2 | min | DRUGBANK | Half-life | 0.42 | h | 0.42 | h | intravenous injection, IV; human, homo sapiens; | Human Intravenous Pharmacokinetic Dataset |
| Toxicity LD50 | 1460.0 | mg/kg | 1460.0 | mg/kg | PO, oral; mouse; | DRUGBANK | Toxicity LD50 | 1780.0 | mg/kg | 1780.0 | mg/kg | PO, oral; Rattus, Rat; | DRUGBANK | Toxicity LD50 | 1460.0 | mg/kg | 1460.0 | mg/kg | PO, oral; mouse; | T3DB | Toxicity LD50 | 1780.0 | mg/kg | 1780.0 | mg/kg | PO, oral; Rattus, Rat; | T3DB |
| Eliminate Route | 80.0 | % | ~80 | % | Urinary excretion; | DRUGBANK |
Maximum Dosage
Not Available
Drug Property Radar Chart
Note: Center: Q1-1.5*IQR, Edge: Q3+1.5*IQR; Q1: Quantile 1, Q3: Quantile 3, IQR: Q3-Q1