BDBM50270506 CHEMBL3299035

SMILES [H][C@@]12N3CC[C@H](O)[C@@]4([H])CC[C@]3(C[C@@]11CN3CC[C@@]1([H])C(=C[C@@]2(O)CC\C=C/CCCC3)c1nccc2c3ccccc3[nH]c12)O[C@@]1([H])CCN2[C@]3([H])[C@@]5(C[C@@]2(CC[C@H]1O)O4)CN1CC[C@@]5([H])C(=C[C@@]3(O)CC\C=C/CCCC1)c1nccc2c3ccccc3[nH]c12

InChI Key InChIKey=QNWBBGISMLEXSK-UHFFFAOYSA-N

Data  1 IC50

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

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50270506   

TargetSortase family protein(Staphylococcus aureus)
Seoul National University

Curated by ChEMBL
LigandPNGBDBM50270506(CHEMBL3299035)
Affinity DataIC50: 1.50E+5nMAssay Description:Inhibition of Staphylococcus aureus ATCC 6538p SortA expressed in Escherichia coli using Dabcyl-QALPETGEE-Edans as substrate after 1 hr by fluorescen...More data for this Ligand-Target Pair
In Depth
Date in BDB:
4/19/2020
Entry Details Article
PubMed