Brief Information of the Compound and Protein
Compound Name
{(S)-1-[(1S,2R)-1-Benzyl-2-hydroxy-2-((16S,19R)-16-isopropyl-15,18-dioxo-2,5,8,11-tetraoxa-14,17,20-triaza-bicyclo[20.2.2]hexacosa-1(25),22(26),23-trien-19-yl)-ethylcarbamoyl]-2-methyl-propyl}-carbamic acid benzyl ester
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PubChem ID
CID: 461283
SID: 15709627
Canonical SMILES
CC(C)[C@H](NC(=O)OCc1ccccc1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)[C@H]1NCc2ccc(cc2)OCCOCCOCCOCCNC(=O)[C@H](C(C)C)NC1=O
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Compound Formula C44H61N5O10
Compound Structure
Protein Name
Pol polyprotein
Protein Classification
Enzyme
>
Protease
>
Aspartic protease
>
Aspartic protease AA clan
>
Aspartic protease A2A subfamily
Uniprot ID
Q72874
Gene Name
POL
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000247 MT-4 Homo sapiens (Human)  1
1
Ki = 7.5 nM
   TI
   LI
   LO
   TS