Brief Information of the Compound and Protein
Compound Name
Remdesivir
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PubChem ID
CID: 121304016
Canonical SMILES
CCC(CC)COC(=O)[C@H](C)N[P@](=O)(OC[C@H]1O[C@](C#N)([C@H](O)[C@@H]1O)c1ccc2c(N)ncnn12)Oc1ccccc1
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Compound Formula C27H35N6O8P
Compound Structure
Protein Name
Replicase polyprotein 1ab
Protein Classification
Enzyme
>
Transferase
Uniprot ID
P0DTD1
Gene Name
REP
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000025 HEK-293T Homo sapiens (Human)  3
1
IC50 = 1190 nM
   TI
   LI
   LO
   TS
2
IC50 = 1560 nM
   TI
   LI
   LO
   TS
3
IC50 = 3110 nM
   TI
   LI
   LO
   TS