Synonyms: | |
Status: | Approved |
Entry Type: | Small molecule |
Molecule Category: | Parent |
UNII: | W4HFE001U5 |
InChI Key | SGOIRFVFHAKUTI-ZCFIWIBFSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C9H14N5O4P |
Molecular Weight | 287.22 |
AlogP | -0.05 |
Hydrogen Bond Acceptor | 7.0 |
Hydrogen Bond Donor | 3.0 |
Number of Rotational Bond | 5.0 |
Polar Surface Area | 136.38 |
Molecular species | ACID |
Aromatic Rings | 2.0 |
Heavy Atoms | 19.0 |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Enzyme
Hydrolase
|
- | 380-380 | 3200 | - | - | |
Structural protein
|
242 | - | - | - | - | |
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 18 |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Severe Acute Respiratory Syndrome | 3 | D045169 | ClinicalTrials |
Infections | 3 | D007239 | ClinicalTrials |
HIV Infections | 3 | D015658 | ClinicalTrials |
Acquired Immunodeficiency Syndrome | 3 | D000163 | ClinicalTrials |
Carcinoma, Hepatocellular | 3 | D006528 | ClinicalTrials |
HIV Infections | 3 | D015658 | ClinicalTrials |
Hepatitis B, Chronic | 3 | D019694 | ClinicalTrials |
Hepatitis B, Chronic | 3 | D019694 | ClinicalTrials |
Hepatitis D | 3 | D003699 | ClinicalTrials |
Insulin Resistance | 1 | D007333 | ClinicalTrials |
Hepatitis C, Chronic | 1 | D019698 | ClinicalTrials |
Resources | Reference |
---|---|
CAS NUMBER | 147127-20-6 |
ChEBI | 63625 |
ChEMBL | CHEMBL483 |
DrugBank | DB14126 |
DrugCentral | 2592 |
EPA CompTox | DTXSID9040132 |
FDA SRS | W4HFE001U5 |
Human Metabolome Database | HMDB0014445 |
Guide to Pharmacology | 10948 |
PDB | TFO |
PharmGKB | PA10204 |
PubChem | 21146529 |
SureChEMBL | SCHEMBL39724 |
ZINC | ZINC000001543475 |
CAS NUMBER | 147127-20-6 |
ChEBI | 63716 |
ChEMBL | CHEMBL3989702 |
FDA SRS | 99YXE507IL |
Guide to Pharmacology | 10948 |
PubChem | 21146529 |
SureChEMBL | SCHEMBL3133902 |