BDBM476944 SARS-CoV-2 3CLpro Inhibitors 2i::SARS-CoV-2 3CLpro Inhibitors 2j

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

InChI Key InChIKey=UYCGANVIMDDJSZ-WXQONFJYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 476944   

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

LigandPNGBDBM476944(SARS-CoV-2 3CLpro Inhibitors 2i | 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

LigandPNGBDBM476944(SARS-CoV-2 3CLpro Inhibitors 2i | SARS-CoV-2 3CLpr...)
Affinity DataIC50:  270nMAssay 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