BDBM50333311 CHEMBL1645287::N1-(4-chloro-3-fluorophenyl)-N2-(2-(4-chlorophenyl)-2-(pyrrolidin-1-yl)ethyl)oxalamide

SMILES: Fc1cc(NC(=O)C(=O)NCC(N2CCCC2)c2ccc(Cl)cc2)ccc1Cl

InChI Key: InChIKey=AFDBDOJIONZGFY-UHFFFAOYSA-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 = 50333311   

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
Envelope glycoprotein gp160 (Human immunodeficiency virus type 1 group M subtyp...)	BDBM50333311 (CHEMBL1645287 | N1-(4-chloro-3-fluorophenyl)-N2-(2...) Show SMILES Fc1cc(NC(=O)C(=O)NCC(N2CCCC2)c2ccc(Cl)cc2)ccc1Cl Show InChI InChI=1S/C20H20Cl2FN3O2/c21-14-5-3-13(4-6-14)18(26-9-1-2-10-26)12-24-19(27)20(28)25-15-7-8-16(22)17(23)11-15/h3-8,11,18H,1-2,9-10,12H2,(H,24,27)(H,25,28)	PDB MMDB UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	6.14E+4	n/a	n/a	n/a	n/a	n/a	n/a
Bryn Mawr College Curated by ChEMBL					Assay Description Inhibition of HIV1 YU2 gp120 binding to CD4 expressing Cf2Th-CD4/CCR5 cells assessed as inhibition of viral infection after 48 hrs				Bioorg Med Chem 19: 91-101 (2011) Article DOI: 10.1016/j.bmc.2010.11.049 BindingDB Entry DOI: 10.7270/Q25H7GHH
					More data for this Ligand-Target Pair