| Trade Names: | |
| Synonyms: | |
| Status: | Approved (1953) |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN Prodrug |
| ATC: | L01BB02 |
| UNII: | E7WED276I5 |
| InChI Key | GLVAUDGFNGKCSF-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C5H6N4OS |
| Molecular Weight | 170.2 |
| AlogP | 0.64 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 0.0 |
| Polar Surface Area | 54.46 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 10.0 |
| Action | Mechanism of Action | Reference |
|---|---|---|
| INHIBITOR | Amidophosphoribosyltransferase inhibitor |
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Precursor Cell Lymphoblastic Leukemia-Lymphoma | 4 | D054198 | ClinicalTrials |
| Precursor Cell Lymphoblastic Leukemia-Lymphoma | 4 | D054198 | ClinicalTrials |
| Leukemia, Myeloid, Acute | 3 | D015470 | ClinicalTrials |
| Crohn Disease | 3 | D003424 | ClinicalTrials |
| Leukemia, Promyelocytic, Acute | 3 | D015473 | ClinicalTrials |
| Leukemia, Biphenotypic, Acute | 3 | D015456 | ClinicalTrials |
| Leukemia | 3 | D007938 | ClinicalTrials |
| Lymphoma | 3 | D008223 | ClinicalTrials |
| Colitis, Ulcerative | 3 | D003093 | ClinicalTrials |
| Histiocytosis, Langerhans-Cell | 3 | D006646 | ClinicalTrials |
| Leukemia, Biphenotypic, Acute | 3 | D015456 | ClinicalTrials |
| Leukemia, Biphenotypic, Acute | 3 | D015456 | ClinicalTrials |
| Precursor T-Cell Lymphoblastic Leukemia-Lymphoma | 3 | D054218 | ClinicalTrials |
| Blastic Plasmacytoid Dendritic Cell Neoplasm | 2 | D000099067 | ClinicalTrials |
| Colitis | 2 | D003092 | ClinicalTrials |
| Glioblastoma | 2 | D005909 | ClinicalTrials |
| Astrocytoma | 2 | D001254 | ClinicalTrials |
| Oligodendroglioma | 2 | D009837 | ClinicalTrials |
| Glioma | 2 | D005910 | ClinicalTrials |
| Brain Neoplasms | 2 | D001932 | ClinicalTrials |
| Burkitt Lymphoma | 1 | D002051 | ClinicalTrials |
| Resources | Reference |
|---|---|
| CAS NUMBER | 50-44-2 |
| ChEBI | 31822 |
| ChEMBL | CHEMBL1200751 |
| DrugBank | DB01033 |
| FDA SRS | E7WED276I5 |
| Human Metabolome Database | HMDB15167 |
| Guide to Pharmacology | 7226 |
| KEGG | C01756 |
| PubChem | 2724350 |
| SureChEMBL | SCHEMBL3893 |
| CAS NUMBER | 50-44-2 |
| ChEBI | 31822 |
| ChEMBL | CHEMBL1425 |
| DrugBank | DB01033 |
| DrugCentral | 1708 |
| EPA CompTox | DTXSID0020810 |
| FDA SRS | E7WED276I5 |
| Human Metabolome Database | HMDB15167 |
| Guide to Pharmacology | 7226 |
| KEGG | C02380 |
| PDB | PM6 |
| PharmGKB | PA450379 |
| PubChem | 2724350 |
| SureChEMBL | SCHEMBL3893 |
| ZINC | ZINC000004658290 |