BDBM50651013 CHEMBL5632639

SMILES CC1=CC(=O)Oc2c1ccc(c2)OCc3cn(nn3)Cc4ccc(c(c4)O)Oc5ccccc5

InChI Key InChIKey=ZRIHXCXHNUJXDW-UHFFFAOYSA-N

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50651013   

TargetEnoyl-[acyl-carrier-protein] reductase [NADH](Mycobacterium tuberculosis (strain ATCC 25618 / H3...)
Universita Toulouse III - Paul Sabatier (UT3)

Curated by ChEMBL
LigandChemical structure of BindingDB Monomer ID 50651013BDBM50651013(CHEMBL5632639)
Affinity DataIC50: 205nMAssay Description:Inhibition of his6-tagged Mycobacterium tuberculosis InhA using trans-2-dodecenoyl-coenzyme as substrate in presence of NADPHMore data for this Ligand-Target Pair
Ligand InfoPC cidPC sidPDB
In Depth
Date in BDB:
10/13/2025
Entry Details
PubMedPDB3D3D Structure (crystal)