Brief Information of the Compound and Protein
Compound Name
 Compound Info 
N-(3-chloro-4-fluorophenyl)-7-methoxy-6-(3-morpholin-4-ylpropoxy)quinazolin-4-amine
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 PubChem ID
CID: 123631
SID: 14833109
Canonical SMILES
COc1cc2ncnc(Nc3ccc(F)c(Cl)c3)c2cc1OCCCN1CCOCC1
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Compound Formula C22H24ClFN4O3
Compound Structure
Protein Name
 Protein Info 
Receptor tyrosine-protein kinase erbB-2
Protein Classification
Enzyme
>
Kinase
>
Protein Kinase
>
TK protein kinase group
>
Tyrosine protein kinase EGFR family
Uniprot ID
P04626
Gene Name
ERBB2
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000083 MCF-7
 Cell Line Info 
Homo sapiens (Human)  1
1
IC50 = 24 nM
   TI
   LI
   LO
   TS
CL000012 Sf21
 Cell Line Info 
Spodoptera frugiperda (Fall armyworm)  1
1
IC50 = 151 nM
   TI
   LI
   LO
   TS
CL000013 Sf9
 Cell Line Info 
Spodoptera frugiperda (Fall armyworm)  2
1
IC50 = 97 nM
   TI
   LI
   LO
   TS
2
IC50 = 343 nM
   TI
   LI
   LO
   TS
CL000203 T24
 Cell Line Info 
Homo sapiens (Human)  1
1
IC50 = 599 nM
   TI
   LI
   LO
   TS
Biochemical Assays
1 IC50 = 240 nM
2 IC50 = 280 nM
3 IC50 = 281 nM
4 IC50 = 343 nM
5 IC50 = 1000 nM
6 IC50 = 1830 nM
7 IC50 = 2700 nM
8 Kd = 1100 nM
9 Kd = 3500 nM