BindingDB logo
myBDB logout

null

SMILES: COc1ccccc1-c1cc(nc(n1)S(=O)(=O)CCCC(O)=O)C(F)(F)F

InChI Key: InChIKey=CRTONYYTUQIFLW-UHFFFAOYSA-N

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 76306   
Target/Host
(Institution)		LigandTarget/Host
Links		Ligand
Links		Trg + Lig
Links		Ki
nM		ΔG°
kcal/mole		IC50
nM		Kd
nM		EC50/IC50
nM		koff
s-1		kon
M-1s-1		pHTemp
°C
Citrate synthase, peroxisomal [1-24]


(Saccharomyces cerevisiae)		BDBM76306
PNG
(4-[4-(2-methoxyphenyl)-6-(trifluoromethyl)pyrimidi...)
Show SMILES COc1ccccc1-c1cc(nc(n1)S(=O)(=O)CCCC(O)=O)C(F)(F)F
Show InChI InChI=1S/C16H15F3N2O5S/c1-26-12-6-3-2-5-10(12)11-9-13(16(17,18)19)21-15(20-11)27(24,25)8-4-7-14(22)23/h2-3,5-6,9H,4,7-8H2,1H3,(H,22,23)
UniProtKB/SwissProt

GoogleScholar
AffyNet 
Purchase

MCE
PC cid
PC sid
UniChem

Similars
PCBioAssay
n/an/an/an/a 5.80E+4n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1R03 MH086450-01 Project Title: Chemical Screen of TOR pathway GFP fusion proteins in S. ...

PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2QN6575
More data for this
Ligand-Target Pair