| Synonyms: | |
| Status: | Phase 2 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | UM47085BXC |
Structure
| InChI Key | LDHMAVIPBRSVRG-UHFFFAOYSA-O |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C7H9N2O+ |
| Molecular Weight | 137.16 |
| AlogP | -0.39 |
| Hydrogen Bond Acceptor | 1.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 46.97 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 10.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
Transferase
|
- | 9000 | - | - | - |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Hyperlipidemias | 2 | D006949 | ClinicalTrials |
Cross References
| Resources | Reference |
|---|---|
| ChEBI | 16797 |
| ChEMBL | CHEMBL71733 |
| DrugBank | DB11710 |
| EPA CompTox | DTXSID10185019 |
| FDA SRS | UM47085BXC |
| Human Metabolome Database | HMDB00699 |
| Guide to Pharmacology | 4658 |
| KEGG | C02918 |
| PDB | 8GC |
| PubChem | 457 |
| SureChEMBL | SCHEMBL132244 |
| ZINC | ZINC000000155368 |
CONTENTS