Synonyms: | |
Status: | Phase 1 |
Entry Type: | Small molecule |
Molecule Category: | UNKNOWN |
UNII: | 7E99B9ZM19 |
InChI Key | MASKQITXHVYVFL-UHFFFAOYSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C22H20N6O4 |
Molecular Weight | 432.44 |
AlogP | 3.38 |
Hydrogen Bond Acceptor | 8.0 |
Hydrogen Bond Donor | 1.0 |
Number of Rotational Bond | 5.0 |
Polar Surface Area | 123.34 |
Molecular species | NEUTRAL |
Aromatic Rings | 4.0 |
Heavy Atoms | 32.0 |
Action | Mechanism of Action | Reference |
---|---|---|
ACTIVATOR | Hexokinase type IV activator | PubMed |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Enzyme
|
174-1090 | - | 189 | - | - | |
Ion channel
Voltage-gated ion channel
Potassium channels
Voltage-gated potassium channel
|
- | - | - | - | 0 |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Diabetes Mellitus, Type 2 | 2 | D003924 | ClinicalTrials |
Resources | Reference |
---|---|
CAS NUMBER | 1245603-92-2 |
ChEMBL | CHEMBL2165615 |
DrugBank | DB15009 |
FDA SRS | 7E99B9ZM19 |
PDB | S41 |
PubChem | 46916694 |
SureChEMBL | SCHEMBL1720691 |
ZINC | ZINC000068246554 |