| Synonyms | |
| Status | |
| Molecule Category | Free-form |
| ATC | A10BA01 |
| UNII | DD5K7529CE |
| EPA CompTox | DTXSID1023449 |
| InChI Key | ICFJFFQQTFMIBG-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C10H15N5 |
| Molecular Weight | 205.26 |
| AlogP | 0.24 |
| Hydrogen Bond Acceptor | 2.0 |
| Hydrogen Bond Donor | 5.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 97.78 |
| Molecular species | BASE |
| Aromatic Rings | 1.0 |
| Heavy Atoms | 15.0 |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | -2.3-34.5 |
| Resources | Reference |
|---|---|
| ChEBI | 8064 |
| ChEMBL | CHEMBL170988 |
| DrugBank | DB00914 |
| DrugCentral | 2126 |
| FDA SRS | DD5K7529CE |
| Human Metabolome Database | HMDB0015050 |
| KEGG | C07673 |
| PDB | 8CV |
| PharmGKB | PA1000 |
| PubChem | 8249 |
| SureChEMBL | SCHEMBL8424 |
| ZINC | ZINC000005851063 |