| Synonyms: | |
| Status: | Phase 1 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | H75J14AA89 |
Structure
| InChI Key | TWFZGCMQGLPBSX-UHFFFAOYSA-N |
|---|---|
| Smile | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C9H9N3O2 |
| Molecular Weight | 191.19 |
| AlogP | 1.74 |
| Hydrogen Bond Acceptor | 3.0 |
| Hydrogen Bond Donor | 2.0 |
| Number of Rotational Bond | 1.0 |
| Polar Surface Area | 67.01 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 14.0 |
Pharmacology
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
Protease
Metallo protease
Metallo protease MG clan
Metallo protease M24A subfamily
|
- | - | - | - | 18 |
Indications
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Lymphoma | 1 | D008223 | ClinicalTrials |
| Neoplasms | 1 | D009369 | ClinicalTrials |
Related Entries
MCS
Cross References
| Resources | Reference |
|---|---|
| CAS NUMBER | 10605-21-7 |
| ChEBI | 3392 |
| ChEMBL | CHEMBL70971 |
| DrugBank | DB13009 |
| EPA CompTox | DTXSID4024729 |
| FDA SRS | H75J14AA89 |
| Human Metabolome Database | HMDB0031769 |
| KEGG | C10897 |
| PubChem | 25429 |
| SureChEMBL | SCHEMBL21051 |
| ZINC | ZINC000000043475 |
CONTENTS