| Synonyms: | |
| Status: | Approved |
| Entry Type: | Small molecule |
| Molecule Category: | Parent |
| ATC: | R06AC05 |
| UNII: | A01LX40298 |
Structure
| InChI Key | HNJJXZKZRAWDPF-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C14H19N3S |
| Molecular Weight | 261.39 |
| AlogP | 2.71 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 0.0 |
| Number of Rotational Bond | 6.0 |
| Polar Surface Area | 19.37 |
| Molecular species | BASE |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 18.0 |
Indications
Related Entries
Scaffolds
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 6820 |
| ChEMBL | CHEMBL1411979 |
| DrugBank | DB04819 |
| DrugCentral | 1738 |
| EPA CompTox | DTXSID2023278 |
| FDA SRS | A01LX40298 |
| KEGG | C11114 |
| PubChem | 4098 |
| SureChEMBL | SCHEMBL19209 |
| ZINC | ZINC000002510048 |
CONTENTS