| Synonyms: | |
| Status: | Phase 1 |
| Entry Type: | Small molecule |
| Molecule Category: | UNKNOWN |
| UNII: | 5D822Y3L1H |
| InChI Key | IAYGCINLNONXHY-LBPRGKRZSA-N |
|---|---|
| Smile | |
| InChI |
|
| Property Name | Value |
|---|---|
| Molecular Formula | C17H19FN4O2S |
| Molecular Weight | 362.43 |
| AlogP | 2.53 |
| Hydrogen Bond Acceptor | 4.0 |
| Hydrogen Bond Donor | 4.0 |
| Number of Rotational Bond | 4.0 |
| Polar Surface Area | 96.25 |
| Molecular species | BASE |
| Aromatic Rings | 2.0 |
| Heavy Atoms | 25.0 |
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
Kinase
Protein Kinase
CAMK protein kinase group
CAMK protein kinase CAMK1 family
CAMK protein kinase CHK1 subfamily
|
10-280 | 5-8 | - | - | - | |
|
Ion channel
Voltage-gated ion channel
Potassium channels
Voltage-gated potassium channel
|
- | 15000-15000 | - | - | - |
| Mesh Heading | Maximum Phase | Mesh ID | Reference |
|---|---|---|---|
| Neoplasms | 1 | D009369 | ClinicalTrials |
| Neoplasms | 1 | D009369 | ClinicalTrials |
| Resources | Reference |
|---|---|
| ChEBI | 131156 |
| ChEMBL | CHEMBL2041933 |
| DrugBank | DB12242 |
| FDA SRS | 5D822Y3L1H |
| Guide to Pharmacology | 7713 |
| PDB | YDJ |
| PubChem | 11152667 |
| SureChEMBL | SCHEMBL1127614 |
| ZINC | ZINC000033359230 |