Brief Information of the Compound and Protein
Compound Name
N-[4-(3-Chloro-4-fluoro-phenylamino)-quinazolin-6-yl]-2-[4-(3-oxo-3H-[1,2]dithiol-4-yl)-phenoxy]-acetamide
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Canonical SMILES
O=C(COc1ccc(-c2cssc2=O)cc1)Nc1ccc2ncnc(Nc3ccc(F)c(Cl)c3)c2c1
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Compound Formula C25H16ClFN4O3S2
Compound Structure
Protein Name
Epidermal growth factor receptor
Protein Classification
Enzyme
>
Kinase
>
Protein Kinase
>
TK protein kinase group
>
Tyrosine protein kinase EGFR family
Uniprot ID
P00533
Gene Name
EGFR
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000068 A-549 Homo sapiens (Human)  1
1
GI50 > 10000 nM
   TI
   LI
   LO
   TS
CL000077 Ba/F3 Mus musculus (Mouse)  3
1
GI50 = 290 nM
   TI
   LI
   LO
   TS
2
GI50 = 2490 nM
   TI
   LI
   LO
   TS
3
GI50 = 3160 nM
   TI
   LI
   LO
   TS
CL000324 NCI-H3255 Homo sapiens (Human)  1
1
GI50 = 4355 nM
   TI
   LI
   LO
   TS