BDBM50192266 (S)-N-(3,5-bis(trifluoromethyl)benzyl)-2-(4-fluorophenyl)-4-(4-(thiophen-3-yl)piperidin-1-yl)butanamide::CHEMBL215515

SMILES: Fc1ccc(cc1)[C@H](CCN1CCC(CC1)c1ccsc1)C(=O)NCc1cc(cc(c1)C(F)(F)F)C(F)(F)F

InChI Key: InChIKey=YVYCNZXAEFCTJA-VWLOTQADSA-N

Data: 1 IC50

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 = 50192266   

Target/Host (Institution)	Ligand	Target/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	pH	Temp °C
C-C chemokine receptor type 2 (Homo sapiens (Human))	BDBM50192266 ((S)-N-(3,5-bis(trifluoromethyl)benzyl)-2-(4-fluoro...) Show SMILES Fc1ccc(cc1)[C@H](CCN1CCC(CC1)c1ccsc1)C(=O)NCc1cc(cc(c1)C(F)(F)F)C(F)(F)F Show InChI InChI=1S/C28H27F7N2OS/c29-24-3-1-20(2-4-24)25(7-11-37-9-5-19(6-10-37)21-8-12-39-17-21)26(38)36-16-18-13-22(27(30,31)32)15-23(14-18)28(33,34)35/h1-4,8,12-15,17,19,25H,5-7,9-11,16H2,(H,36,38)/t25-/m0/s1	PDB KEGG UniProtKB/SwissProt antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
Merck Research Laboratories Curated by ChEMBL					Assay Description Inhibition of [125I]MCP1 binding to CCR2 expressed in CHO cells				J Med Chem 49: 4801-4 (2006) Article DOI: 10.1021/jm060439n BindingDB Entry DOI: 10.7270/Q2VQ329M
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