Synonyms: | |
Status: | Phase 2 |
Entry Type: | Small molecule |
Molecule Category: | UNKNOWN |
UNII: | OEI6OOU6IK |
InChI Key | LPFWVDIFUFFKJU-UHFFFAOYSA-N |
---|---|
Smile | |
InChI |
|
Property Name | Value |
---|---|
Molecular Formula | C23H21Cl2FN4O3 |
Molecular Weight | 491.35 |
AlogP | 5.38 |
Hydrogen Bond Acceptor | 6.0 |
Hydrogen Bond Donor | 1.0 |
Number of Rotational Bond | 6.0 |
Polar Surface Area | 76.58 |
Molecular species | NEUTRAL |
Aromatic Rings | 3.0 |
Heavy Atoms | 33.0 |
Action | Mechanism of Action | Reference |
---|---|---|
INHIBITOR | Epidermal growth factor receptor inhibitor | PubMed |
Primary Target | |
---|---|
epidermal growth factor receptor | |
erb-b2 receptor tyrosine kinase 2 | |
erb-b2 receptor tyrosine kinase 4 |
Targets | EC50(nM) | IC50(nM) | Kd(nM) | Ki(nM) | Inhibition(%) | |
---|---|---|---|---|---|---|
Enzyme
Kinase
Protein Kinase
TK protein kinase group
Tyrosine protein kinase EGFR family
|
- | 0-4 | - | - | - |
Mesh Heading | Maximum Phase | Mesh ID | Reference |
---|---|---|---|
Breast Neoplasms | 2 | D001943 | ClinicalTrials |
Head and Neck Neoplasms | 2 | D006258 | ClinicalTrials |
Adenocarcinoma of Lung | 2 | D000077192 | ClinicalTrials |
Esophageal Neoplasms | 2 | D004938 | ClinicalTrials |
Carcinoma, Non-Small-Cell Lung | 2 | D002289 | ClinicalTrials |
Neoplasms | 1 | D009369 | ClinicalTrials |
Stomach Neoplasms | 1 | D013274 | ClinicalTrials |
Neoplasms | 1 | D009369 | ClinicalTrials |
Resources | Reference |
---|---|
CAS NUMBER | 1092364-38-9 |
ChEMBL | CHEMBL3545154 |
DrugBank | DB12114 |
EPA CompTox | DTXSID80148853 |
FDA SRS | OEI6OOU6IK |
Guide to Pharmacology | 7903 |
PubChem | 25127713 |
SureChEMBL | SCHEMBL3391764 |
ZINC | ZINC000095930125 |