Trade Names | |
Synonyms | |
Status | |
Molecule Category | Free-form |
UNII | X6Q56QN5QC |
EPA CompTox | DTXSID6025438 |
InChI Key | VSNHCAURESNICA-UHFFFAOYSA-N | |
---|---|---|
Smiles | ||
InChI |
|
Property Name | Value | |
---|---|---|
Molecular Formula | CH4N2O2 | |
Molecular Weight | 76.05 | |
AlogP | -0.96 | |
Hydrogen Bond Acceptor | 2.0 | |
Hydrogen Bond Donor | 3.0 | |
Number of Rotational Bond | 0.0 | |
Polar Surface Area | 75.35 | |
Molecular species | NEUTRAL | |
Aromatic Rings | 0.0 | |
Heavy Atoms | 5.0 |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | ||
---|---|---|---|---|---|---|---|
Enzyme
Lyase
|
- | - | - | 23000 | - | ||
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 113 |
Resources | Reference | |
---|---|---|
ChEBI | 44423 | |
ChEMBL | CHEMBL467 | |
DrugBank | DB01005 | |
DrugCentral | 1399 | |
FDA SRS | X6Q56QN5QC | |
Human Metabolome Database | HMDB0015140 | |
Guide to Pharmacology | 6822 | |
KEGG | C07044 | |
PDB | NHY | |
PharmGKB | PA449942 | |
PubChem | 3657 | |
SureChEMBL | SCHEMBL4004 | |
ZINC | ZINC000008034120 |