| Synonyms: | |
| Status: | Approved (1994) |
| Entry Type: | Small molecule |
| Molecule Category: | Parent |
| UNII: | 5UX2SD1KE2 |
Structure
| InChI Key | UFULAYFCSOUIOV-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C2H7NS |
| Molecular Weight | 77.15 |
| AlogP | -0.13 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 26.02 |
| Molecular species | BASE |
| Aromatic Rings | 0.0 |
| Heavy Atoms | 4.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC22 family of organic cation and anion transporters
|
- | - | - | - | 2 |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Cystinosis | 3 | D003554 | ClinicalTrials |
| Cystic Fibrosis | 2 | D003550 | ClinicalTrials |
| HIV Infections | 2 | D015658 | ClinicalTrials |
| Fatty Liver | 1 | D005234 | ClinicalTrials |
Related Entries
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 60-23-1 |
| ChEBI | 17141 |
| ChEMBL | CHEMBL602 |
| DrugBank | DB00847 |
| DrugCentral | 768 |
| EPA CompTox | DTXSID3022875 |
| FDA SRS | 5UX2SD1KE2 |
| Human Metabolome Database | HMDB0002991 |
| Guide to Pharmacology | 7440 |
| KEGG | C01678 |
| PDB | DHL |
| PharmGKB | PA449171 |
| PubChem | 6058 |
| SureChEMBL | SCHEMBL16369 |
| ZINC | ZINC000008034121 |
CONTENTS