| Synonyms: | |
| Status: | Phase 2 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | 11978226XX |
| InChI Key | QSKQVZWVLOIIEV-NSHDSACASA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C15H18FN3O2S |
| Molecular Weight | 323.39 |
| AlogP | 1.75 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 1.0 |
| Number of Rotational Bond | 2.0 |
| Polar Surface Area | 62.3 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 22.0 |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
Kinase
Protein Kinase
AGC protein kinase group
AGC protein kinase DMPK family
AGC protein kinase ROCK subfamily
|
- | 4-197 | - | - | - |
| Resources | Reference |
|---|---|
| ChEBI | 136046 |
| ChEMBL | CHEMBL3426621 |
| DrugBank | DB13165 |
| DrugCentral | 4938 |
| FDA SRS | 11978226XX |
| Guide to Pharmacology | 10423 |
| PubChem | 9863672 |
| SureChEMBL | SCHEMBL31542 |
| ZINC | ZINC000003940873 |