BDBM50323480 CHEMBL1209356::N-((2S,3R)-1-(3,5-difluorophenyl)-3-hydroxy-4-(1-(3-(tetrahydrofuran-2-yl)phenyl)cyclopropylamino)butan-2-yl)acetamide

SMILES: CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1cccc(c1)C1CCCO1

InChI Key: InChIKey=DGXDCVZUXDMTLV-XAGPSQNTSA-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 = 50323480   

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
Beta-secretase 1 (Homo sapiens (Human))	BDBM50323480 (CHEMBL1209356 | N-((2S,3R)-1-(3,5-difluorophenyl)-...) Show SMILES CC(=O)N[C@@H](Cc1cc(F)cc(F)c1)[C@H](O)CNC1(CC1)c1cccc(c1)C1CCCO1 |r| Show InChI InChI=1S/C25H30F2N2O3/c1-16(30)29-22(12-17-10-20(26)14-21(27)11-17)23(31)15-28-25(7-8-25)19-5-2-4-18(13-19)24-6-3-9-32-24/h2,4-5,10-11,13-14,22-24,28,31H,3,6-9,12,15H2,1H3,(H,29,30)/t22-,23+,24?/m0/s1	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	580	n/a	n/a	n/a	n/a	n/a	n/a
Elan Pharmaceuticals Curated by ChEMBL					Assay Description Inhibition of recombinant BACE-1 expressed in Escherichia coli after 3 hrs by fluorescence polarization assay				Bioorg Med Chem Lett 20: 4789-94 (2010) Article DOI: 10.1016/j.bmcl.2010.06.112 BindingDB Entry DOI: 10.7270/Q23N24CF
					More data for this Ligand-Target Pair