BDBM50630021 CHEMBL5421070

SMILES [H][C@@]12CCC[C@]1([H])[C@H](N(C2)C(=O)[C@@H](NC(=O)[C@@H](F)Cl)[C@@H](C)CC)C(=O)NN(C[C@]1([H])CCCNC1=O)C(=O)[C@@H](F)Cl

InChI Key InChIKey=KBTQAYVMSRLKBV-UHFFFAOYSA-N

Data  1 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 1 hit for monomerid = 50630021   

TargetReplicase polyprotein 1ab(2019-nCoV)
Smith, Gambrell & Russell

Curated by ChEMBL
LigandPNGBDBM50630021(CHEMBL5421070)
Affinity DataIC50: 7nMAssay Description:Inhibition of full-length recombinant SARS-CoV-2 3CL protease expressed in Escherichia coli BL21 (DE3) using FAM- KTSAVLQSGFRKMEK-TAMRA as substrate ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/20/2024
Entry Details
PubMed