| Synonyms: | |
| Status: | Phase 2 |
| Entry Type: | Small molecule |
| Molecule Category: | Parent |
| ATC: | J01XX11 |
| UNII: | 97HLQ82NGL |
Structure
| InChI Key | XFALPSLJIHVRKE-GFCCVEGCSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C17H15FN6O3 |
| Molecular Weight | 370.34 |
| AlogP | 1.4 |
| Hydrogen Bond Acceptor | 8.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 106.26 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 3.0 |
| Heavy Atoms | 27.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
Oxidoreductase
|
- | 5700 | - | - | - |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Bacterial Infections | 4 | D001424 | ClinicalTrials |
| Infections | 2 | D007239 | ClinicalTrials |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 856866-72-3 |
| ChEBI | 82717 |
| ChEMBL | CHEMBL1257051 |
| DrugBank | DB14569 |
| EPA CompTox | DTXSID10234975 |
| FDA SRS | 97HLQ82NGL |
| Guide to Pharmacology | 10865 |
| PDB | U7V |
| PubChem | 11234049 |
| SureChEMBL | SCHEMBL440398 |
| ZINC | ZINC000043100956 |
CONTENTS