BDBM50164168 1,3,4-Eugenol::1-Hydroxy-2-methoxy-4-allylbenzene::1-Hydroxy-2-methoxy-4-prop-2-enylbenzene::1-Hydroxy-2-methoxy-4-propenylbenzene::1-allyl-3-methoxy-4-hydroxybenzene::1-allyl-4-hydroxy-3-methoxybenzene::2-Hydroxy-5-allylanisole::2-Methoxy-1-hydroxy-4-allylbenzene::2-Methoxy-4-allylphenol::2-Methoxy-4-prop-2-enylphenol::2-methoxy-4-(prop-2-en-1-yl)phenol4-allyl-2-methoxyphenol::4-Allyl-1-hydroxy-2-methoxybenzene::4-Allylcatechol-2-methyl ether::4-Allylguaiacol::4-Hydroxy-3-methoxy-1-allylbenzene::Allylguaiacol::CHEMBL42710::Caryophyllic acid::Eugenic acid::Eugenol::p-Allylguaiacol::p-Eugenol

SMILES COc1cc(CC=C)ccc1O

InChI Key InChIKey=RRAFCDWBNXTKKO-UHFFFAOYSA-N

Data  9 IC50  5 EC50

PDB links: 4 PDB IDs match this monomer.

  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 = 50164168   

TargetSecreted chorismate mutase(Mycobacterium tuberculosis H37Rv)
Birla Institute of Technology

LigandPNGBDBM50164168(1,3,4-Eugenol | 1-Hydroxy-2-methoxy-4-allylbenzene...)
Affinity DataIC50:  2.86E+4nMpH: 7.5 T: 2°CAssay Description:Reaction volumes of 0.4 mL of chorismate (typically, 1 mM) in 50 mM Tris-HCl (pH 7.5), 0.5 mM EDTA, 0.1 mg/mL bovine serum albumin, and 10 mM β-...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed