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 |