Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Carboxylic ester hydrolase' and Ligand = 'BDBM222160'   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Carboxylic ester hydrolase (Equus caballus (Horse))	BDBM222160 (6,8-dibromo-2-methyl-2-propyl-2,3-dihydroquinazoli...) Show SMILES CCCC1(C)NC(=O)c2cc(Br)cc(Br)c2N1 Show InChI InChI=1S/C12H14Br2N2O/c1-3-4-12(2)15-10-8(11(17)16-12)5-7(13)6-9(10)14/h5-6,15H,3-4H2,1-2H3,(H,16,17)	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	2.34E+4	n/a	n/a	n/a	n/a	8.0	n/a
University of Sargodha					Assay Description Galantamine was used as reference drugs. The synthesized quinazolines were dissolved in 0.1 M phosphate buffer of pH 8.0. (KH2PO4/K2HPO4. The reactio...				Bioorg Chem 70: 237-244 (2017) Article DOI: 10.1016/j.bioorg.2017.01.004 BindingDB Entry DOI: 10.7270/Q2M0448Z
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