Brief Information of the Compound and Protein
Compound Name
VELPATASVIR
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PubChem ID
CID: 67683363
Canonical SMILES
COC[C@H]1C[C@@H](c2nc(-c3ccc4c(c3)COc3cc5c(ccc6nc([C@@H]7CC[C@H](C)N7C(=O)[C@@H](NC(=O)OC)C(C)C)[nH]c65)cc3-4)c[nH]2)N(C(=O)[C@H](NC(=O)OC)c2ccccc2)C1
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Compound Formula C49H54N8O8
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
CL000148 Huh-7 Homo sapiens (Human)  16
1
EC50 = 0.01 nM
   TI
   LI
   LO
   TS
2
EC50 = 0.011 nM
   TI
   LI
   LO
   TS
3
EC50 = 0.013 nM
   TI
   LI
   LO
   TS
4
EC50 = 0.014 nM
   TI
   LI
   LO
   TS
5
EC50 = 0.016 nM
   TI
   LI
   LO
   TS
6
EC50 = 0.031 nM
   TI
   LI
   LO
   TS
7
EC50 = 0.032 nM
   TI
   LI
   LO
   TS
8
EC50 = 0.053 nM
   TI
   LI
   LO
   TS
9
EC50 = 0.054 nM
   TI
   LI
   LO
   TS
10
EC50 = 0.105 nM
   TI
   LI
   LO
   TS
11
EC50 = 0.13 nM
   TI
   LI
   LO
   TS
12
EC50 = 0.21 nM
   TI
   LI
   LO
   TS
13
EC50 = 0.22 nM
   TI
   LI
   LO
   TS
14
EC50 = 0.25 nM
   TI
   LI
   LO
   TS
15
EC50 = 3.2 nM
   TI
   LI
   LO
   TS
16
EC50 = 8.5 nM
   TI
   LI
   LO
   TS