Synonyms: | |
Status: | Phase 2 |
Entry Type: | Small molecule |
Molecule Category: | UNKNOWN |
UNII: | 5CSZ8459RP |
InChI Key | UHDGCWIWMRVCDJ-XVFCMESISA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C9H13N3O5 |
Molecular Weight | 243.22 |
AlogP | -2.56 |
Hydrogen Bond Acceptor | 8.0 |
Hydrogen Bond Donor | 4.0 |
Number of Rotational Bond | 2.0 |
Polar Surface Area | 130.83 |
Molecular species | NEUTRAL |
Aromatic Rings | 1.0 |
Heavy Atoms | 17.0 |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Enzyme
Transferase
|
- | - | - | - | 1 | |
Enzyme
|
- | - | - | - | 1 | |
Transporter
Electrochemical transporter
SLC superfamily of solute carriers
SLC21/SLCO family of organic anion transporting polypeptides
|
- | - | - | - | 114 |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Bipolar Disorder | 2 | D001714 | ClinicalTrials |
Resources | Reference |
---|---|
ChEBI | 17562 |
ChEMBL | CHEMBL95606 |
DrugBank | DB02097 |
EPA CompTox | DTXSID60891552 |
FDA SRS | 5CSZ8459RP |
Guide to Pharmacology | 4728 |
KEGG | C00475 |
PDB | CTN |
PubChem | 6175 |
SureChEMBL | SCHEMBL7179 |
ZINC | ZINC000002583632 |