| Trade Names: | |
| Synonyms: | |
| Status: | Approved (1962) |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | W7KQ46GJ8U |
Structure
| InChI Key | IDPUKCWIGUEADI-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C8H11Cl2N3O2 |
| Molecular Weight | 252.1 |
| AlogP | 0.35 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 5.0 |
| Polar Surface Area | 68.96 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 15.0 |
Pharmacology
Indications
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 66-75-1 |
| ChEBI | 9884 |
| ChEMBL | CHEMBL1488 |
| DrugBank | DB00791 |
| DrugCentral | 2795 |
| EPA CompTox | DTXSID8026270 |
| FDA SRS | W7KQ46GJ8U |
| Human Metabolome Database | HMDB0014929 |
| Guide to Pharmacology | 7621 |
| KEGG | C11686 |
| PharmGKB | PA451830 |
| PubChem | 6194 |
| SureChEMBL | SCHEMBL4091 |
| ZINC | ZINC000000002235 |
CONTENTS