| Synonyms: | |
| Status: | Approved (1996) | 
| Entry Type: | Small molecule | 
| Molecule Category: | UNKNOWN | 
| ATC: | J01XX01 | 
| UNII: | 2N81MY12TE | 
| InChI Key | YMDXZJFXQJVXBF-STHAYSLISA-N | 
|---|---|
| Smile | |
| InChI |  | 
| Property Name | Value | 
|---|---|
| Molecular Formula | C3H7O4P | 
| Molecular Weight | 138.06 | 
| AlogP | -0.09 | 
| Hydrogen Bond Acceptor | 2.0 | 
| Hydrogen Bond Donor | 2.0 | 
| Number of Rotational Bond | 1.0 | 
| Polar Surface Area | 70.06 | 
| Molecular species | ACID | 
| Aromatic Rings | 0.0 | 
| Heavy Atoms | 8.0 | 
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
| Enzyme
                                        
                                        
                                         
                                        
                                        
                                        
                                        
                                        
                                        
                                         Transferase | - | 100-8800 | - | - | - | |
| Membrane receptor
                                        
                                        
                                         
                                        
                                        
                                        
                                        
                                        
                                        
                                         Family A G protein-coupled receptor
                                        
                                        
                                        
                                         
                                         
                                        
                                        
                                        
                                         Small molecule receptor (family A GPCR)
                                        
                                         
                                         
                                        
                                        
                                        
                                        
                                        
                                          Monoamine receptor
                                        
                                        
                                        
                                         
                                         
                                        
                                        
                                        
                                          Dopamine receptor | - | - | - | - | 
| Mesh Heading | Maximum Phase | Mesh ID | Reference | 
|---|---|---|---|
| Staphylococcal Infections | 3 | D013203 | ClinicalTrials | 
| Urinary Tract Infections | 3 | D014552 | ClinicalTrials | 
| Gonorrhea | 3 | D006069 | ClinicalTrials | 
| Pneumonia, Bacterial | 2 | D018410 | ClinicalTrials | 
| Neonatal Sepsis | 2 | D000071074 | ClinicalTrials | 
| Neoplasms | 2 | D009369 | ClinicalTrials | 
| Pyelonephritis | 2 | D011704 | ClinicalTrials | 
| Appendicitis | 2 | D001064 | ClinicalTrials | 
| Precursor Cell Lymphoblastic Leukemia-Lymphoma | 1 | D054198 | ClinicalTrials | 
| Pseudomonas Infections | 1 | D011552 | ClinicalTrials | 
| Osteomyelitis | 0 | D010019 | ClinicalTrials | 
| Infections | 0 | D007239 | ClinicalTrials | 
| Resources | Reference | 
|---|---|
| ChEBI | 28915 | 
| ChEMBL | CHEMBL1757 | 
| DrugBank | DB00828 | 
| DrugCentral | 1243 | 
| EPA CompTox | DTXSID4048480 | 
| FDA SRS | 2N81MY12TE | 
| Human Metabolome Database | HMDB0014966 | 
| Guide to Pharmacology | 10813 | 
| KEGG | C06454 | 
| PDB | FCN | 
| PharmGKB | PA164748039 | 
| SureChEMBL | SCHEMBL50951 | 
| ZINC | ZINC000001530427 |