BDBM525199 N-[(1S)-2-[2-(3-amino-3-oxo-propyl)-2-(2-chloroacetyl)hydrazino]-1-(cyclohexylmethyl)-2-oxo-ethyl]-5-methyl-isoxazole-3-carboxamide ::WO2022043374, Example 48

SMILES Cc1cc(no1)C(=O)N[C@@H](CC1CCCCC1)C(=O)NN(CCC(N)=O)C(=O)CCl

InChI Key InChIKey=MBIAYIJPUBZDIZ-AWEZNQCLSA-N

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 = 525199   

TargetReplicase polyprotein 1ab(2019-nCoV)
A*Star

Curated by ChEMBL
LigandPNGBDBM525199(N-[(1S)-2-[2-(3-amino-3-oxo-propyl)-2-(2-chloroace...)
Affinity DataIC50:  4nMAssay Description:Inhibition of recombinant SARS-CoV-2 3CLpro expressed in Escherichia coli BL21 DE3 using FAM-KTSAVLQSGFRKMEK-TAMRA fluorogenic peptide as substrate p...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails PubMed
TargetReplicase polyprotein 1ab(2019-nCoV)
A*Star

Curated by ChEMBL
LigandPNGBDBM525199(N-[(1S)-2-[2-(3-amino-3-oxo-propyl)-2-(2-chloroace...)
Affinity DataIC50:  4nMAssay Description:For the SARS-CoV-2 3CLpro assay, 2 μL of 0.02 μM recombinant SARS-CoV-2 3CL protease were mixed with serial dilutions of each c...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails PubMed