Trade Names: | |
Synonyms: | |
Status: | Approved (1995) |
Entry Type: | Small molecule |
Molecule Category: | Salt |
UNII: | 4988K7X26P |
Parent Compound: |
InChI Key | CAKRAHQRJGUPIG-UHFFFAOYSA-M |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C4H12NNaO7P2 |
Molecular Weight | 271.08 |
AlogP | -1.27 |
Hydrogen Bond Acceptor | 4.0 |
Hydrogen Bond Donor | 6.0 |
Number of Rotational Bond | 5.0 |
Polar Surface Area | 161.31 |
Molecular species | ZWITTERION |
Aromatic Rings | 0.0 |
Heavy Atoms | 14.0 |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Enzyme
Isomerase
|
- | 1700 | - | - | - | |
Enzyme
Transferase
|
- | 15000-15000 | - | - | - |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Breast Neoplasms | 3 | D001943 | ClinicalTrials |
Vitamin D Deficiency | 3 | D014808 | ClinicalTrials |
Resources | Reference |
---|---|
ChEMBL | CHEMBL675 |
FDA SRS | 4988K7X26P |
PubChem | 60736 |
SureChEMBL | SCHEMBL328770 |