BDBM50591871 CHEMBL5195094

SMILES COc1cccc(OC)c1NC(=O)[C@]12CC[C@@H](C)[C@H](C)[C@H]1C1=CC[C@@H]3[C@@]4(C)CC[C@H](O[C@@H]5O[C@H](CO)[C@@H](O[C@@H]6O[C@@H](C)[C@H](O)[C@@H](O)[C@H]6O)[C@H](O)[C@H]5O[C@@H]5O[C@@H](C)[C@H](O)[C@@H](O)[C@H]5O)C(C)(C)[C@@H]4CC[C@@]3(C)[C@]1(C)CC2

InChI Key InChIKey=JFPIDZFDYVFISK-UHFFFAOYSA-N

Data  1 Kd

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50591871   

TargetSpike glycoprotein(2019-nCoV)
South China Agricultural University

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50591871BDBM50591871(CHEMBL5195094)
Affinity DataKd:  780nMAssay Description:Binding affinity to SARS-CoV-2 Spike trimer protein by SPR analysisMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/20/2023
Entry Details
PubMed