BDBM50630730 CHEMBL5416260

SMILES COC1CN(C1)C(=O)c1ccc(CC(NC(=O)c2nc(no2)-c2ccc(OC)c(OC)c2)C#N)cc1

InChI Key InChIKey=HSDGASMRFYLBJY-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50630730   

TargetPolyketide synthase Pks13(Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
University of Dundee

Curated by ChEMBL
LigandPNGBDBM50630730(CHEMBL5416260)
Affinity DataIC50: 400nMAssay Description:Inhibition of Mycobacterium tuberculosis N-terminal His-6 tagged Pks13 thioesterase domain expressed in Escherichia coli BL21 (DE3) using 4-methylumb...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/20/2024
Entry Details
PubMed