Brief Information of the Compound and Protein
Compound Name
 Compound Info 
Methyl [(S)-1-((S)-2-{5-[4-(4-{2-[(S)-1-((R)-2-methoxycarbonylamino-2-phenylacetyl)pyrrolidin-2-yl]-3H-imidazol-4-yl}buta-1,3-diynyl)-3-(methylphenylamino)phenyl]-1H-imidazol-2-yl}pyrrolidine-1-carbonyl)-2-methylpropyl]carbamate dihydrochloride
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Canonical SMILES
COC(=O)N[C@H](C(=O)N1CCC[C@H]1c1ncc(-c2ccc(C#CC#Cc3cnc([C@@H]4CCCN4C(=O)[C@H](NC(=O)OC)c4ccccc4)[nH]3)c(N(C)c3ccccc3)c2)[nH]1)C(C)C.Cl.Cl
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Compound Formula C48H53Cl2N9O6
Compound Structure
Protein Name
 Protein Info 
Nonstructural protein 5A
Protein Classification
Unclassified protein
Uniprot ID
Q5L478
Gene Name
NS5A
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000148 Huh-7
 Cell Line Info 
Homo sapiens (Human)  5
1
IC50 = 0.0106 nM
   TI
   LI
   LO
   TS
2
IC50 = 0.011 nM
   TI
   LI
   LO
   TS
3
IC50 = 0.027 nM
   TI
   LI
   LO
   TS
4
IC50 = 0.035 nM
   TI
   LI
   LO
   TS
5
IC50 = 0.072 nM
   TI
   LI
   LO
   TS