BDBM23448 BUTYLPARABEN::Butyl paraben::Nipabutyl::butyl 4-hydroxybenzoate::cid_7184

SMILES CCCCOC(=O)c1ccc(O)cc1

InChI Key InChIKey=QFOHBWFCKVYLES-UHFFFAOYSA-N

Data  1 KI  2 IC50  1 EC50  1 ITC

PDB links: 3 PDB IDs match this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 23448   

TargetOxysterols receptor LXR-beta(Homo sapiens (Human))
Sun Yat-Sen University

Curated by ChEMBL
LigandPNGBDBM23448(BUTYLPARABEN | Butyl paraben | Nipabutyl | butyl 4...)
Affinity DataKi:  6.60E+4nMAssay Description:Binding affinity to recombinant human LXRbeta-LBD expressed in Escherichia coli BL21 (DE3) assessed as inhibitory constant incubated for 30 mins by f...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 23448   

CellTranscriptional Regulator TtgR(Pseudomonas putida)
Estacion Experimental Del Zaidin

SyringePNGBDBM23448(BUTYLPARABEN | Butyl paraben | Nipabutyl | butyl 4...)
ITC DataΔG°: -6.51kcal/mole −TΔS°: -2.03kcal/mole ΔH°: -4.48kcal/mole logk: 5.07E+4
pH: 7.0 T: 30.00°C