| Synonyms: | |
| Status: | Approved |
| Entry Type: | Small molecule |
| Molecule Category: | Parent |
| UNII: | 42HK56048U |
Structure
| InChI Key | OUYCCCASQSFEME-QMMMGPOBSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H11NO3 |
| Molecular Weight | 181.19 |
| AlogP | 0.35 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 83.55 |
| Molecular species | ZWITTERION |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 13.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC03 and SLC07 families of heteromeric amino acid transporters (HATs)
SLC07 Cationic amino acid transporter/glycoprotein-associated family
|
- | 68000 | - | - | 68-68 |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Myopathies, Nemaline | 2 | D017696 | ClinicalTrials |
| Obesity | 1 | D009765 | ClinicalTrials |
Related Entries
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 60-18-4 |
| ChEBI | 58315 |
| ChEMBL | CHEMBL925 |
| DrugBank | DB00135 |
| DrugCentral | 2786 |
| EPA CompTox | DTXSID1023730 |
| FDA SRS | 42HK56048U |
| Human Metabolome Database | HMDB0000158 |
| Guide to Pharmacology | 4791 |
| KEGG | C00082 |
| PDB | TYR |
| PharmGKB | PA451822 |
| PubChem | 6057 |
| SureChEMBL | SCHEMBL1581 |
| ZINC | ZINC000000266964 |
CONTENTS