| Synonyms: | |
| Status: | Approved (2012) |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | 95D580798S |
Structure
| InChI Key | UJIDKYTZIQTXPM-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C18H15NO8S2 |
| Molecular Weight | 437.45 |
| AlogP | 2.63 |
| Hydrogen Bond Acceptor | 7.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 7.0 |
| Polar Surface Area | 140.09 |
| Molecular species | ACID |
| Aromatic Rings | 3.0 |
| Heavy Atoms | 29.0 |
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEMBL | CHEMBL1741134 |
| DrugBank | DB09268 |
| EPA CompTox | DTXSID70143251 |
| FDA SRS | 95D580798S |
| PubChem | 5243 |
| SureChEMBL | SCHEMBL18552552 |
| ZINC | ZINC000003873921 |
CONTENTS