BDBM476945 SARS-CoV-2 3CLpro Inhibitors 3i::SARS-CoV-2 3CLpro Inhibitors 3j

SMILES CCCCCC12CCC(COC(=O)N[C@@H](CC(C)C)C(=O)NC(CC3CCNC3=O)C(O)S([O-])(=O)=O)(CC1)CC2

InChI Key InChIKey=MADFDBAXBFAOMQ-YHSPCDQASA-M

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 476945   

TargetReplicase polyprotein 1ab(2019-nCoV)
Wichita State University

LigandPNGBDBM476945(SARS-CoV-2 3CLpro Inhibitors 3i | SARS-CoV-2 3CLpr...)
Affinity DataIC50:  310nMAssay Description:Cloning and Expression of the 3CL Protease of SARS-CoV-2 and FRET Enzyme Assays. The codon-optimized cDNA of full length of 3CLpro of SARS-CoV-2 (Gen...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
Wichita State University

LigandPNGBDBM476945(SARS-CoV-2 3CLpro Inhibitors 3i | SARS-CoV-2 3CLpr...)
Affinity DataIC50:  300nMAssay Description:Cloning and Expression of the 3CL Protease of SARS-CoV-2 and FRET Enzyme Assays. The codon-optimized cDNA of full length of 3CLpro of SARS-CoV-2 (Gen...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails ArticlePubMed