| Synonyms: | |
| Status: | Approved (1972) |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | D51WO0G0L4 |
Structure
| InChI Key | XDDJGVMJFWAHJX-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C16H11ClN2O3 |
| Molecular Weight | 314.73 |
| AlogP | 2.58 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 78.76 |
| Molecular species | ACID |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 22.0 |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 3761 |
| ChEMBL | CHEMBL1213252 |
| DrugBank | DB00628 |
| DrugCentral | 711 |
| EPA CompTox | DTXSID20863674 |
| FDA SRS | D51WO0G0L4 |
| Human Metabolome Database | HMDB0014766 |
| Guide to Pharmacology | 7548 |
| KEGG | C06921 |
| PharmGKB | PA164749297 |
| PubChem | 2809 |
| SureChEMBL | SCHEMBL1649064 |
CONTENTS