| Synonyms | |
| Status | |
| Molecule Category | UNKNOWN |
| UNII | DW2NWI3TFN |
Structure
| InChI Key | MMNNTJYFHUDSKL-UHFFFAOYSA-N |
|---|---|
| Smiles | |
| InChI |
|
Physicochemical Descriptors
| Property Name | Value |
|---|---|
| Molecular Formula | C24H19ClN4O4 |
| Molecular Weight | 462.89 |
| AlogP | 4.56 |
| Hydrogen Bond Acceptor | 5.0 |
| Hydrogen Bond Donor | 3.0 |
| Number of Rotational Bond | 3.0 |
| Polar Surface Area | 107.55 |
| Molecular species | NEUTRAL |
| Aromatic Rings | 4.0 |
| Heavy Atoms | 33.0 |
Bioactivity
| Mechanism of Action | Action | Reference |
|---|---|---|
| Serine/threonine-protein kinase B-raf inhibitor | INHIBITOR | PubMed Other Other PubMed |
|
Protein: Serine/threonine-protein kinase RAF Description: RAF proto-oncogene serine/threonine-protein kinase Organism : Homo sapiens P04049 ENSG00000132155 |
|
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|
Protein: Serine/threonine-protein kinase B-raf Description: Serine/threonine-protein kinase B-raf Organism : Homo sapiens P15056 ENSG00000157764 |
|
|||
| Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
|---|---|---|---|---|---|---|
|
Enzyme
Kinase
Protein Kinase
TKL protein kinase group
TKL protein kinase RAF family
|
- | 6-2000 | - | - | - |
Cross References
| Resources | Reference |
|---|---|
| ChEMBL | CHEMBL3545027 |
| DrugBank | DB12854 |
| FDA SRS | DW2NWI3TFN |
| Guide to Pharmacology | 7968 |
| SureChEMBL | SCHEMBL10049428 |
CONTENTS