Brief Information of the Compound and Protein
Compound Name
methyl N-[(1S)-1-[(8S)-8-[5-[4-[4-[2-[(3S,6R,9aS)-6-(dimethylamino)-5-oxo-1,2,3,6,7,8,9,9a-octahydropyrrolo[1,2-a]azepin-3-yl]-1H-imidazol-5-yl]phenyl]phenyl]-1H-imidazol-2-yl]-1,4-dioxa-7-azaspiro[4.4]nonane-7-carbonyl]-2-methyl-propyl]carbamate
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Canonical SMILES
COC(=O)N[C@H](C(=O)N1CC2(C[C@H]1c1ncc(-c3ccc(-c4ccc(-c5cnc([C@@H]6CC[C@@H]7CCC[C@@H](N(C)C)C(=O)N76)[nH]5)cc4)cc3)[nH]1)OCCO2)C(C)C
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Compound Formula C42H52N8O6
Compound Structure
Protein Name
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
CL000322 Huh-7-Lunet Homo sapiens (Human)  2
1
EC50 = 0.217 nM
   TI
   LI
   LO
   TS
2
EC50 = 119.15 nM
   TI
   LI
   LO
   TS