BDBM50482818 CHEMBL1257823

SMILES: Oc1c(nc2ccc(cn2c1=O)N1CCOCC1)-c1nnc(Cc2ccc(F)cc2)s1

InChI Key: InChIKey=QYEQAZMKUAVAQT-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 = 50482818   

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
Integrase (Human immunodeficiency virus 1)	BDBM50482818 (CHEMBL1257823) Show SMILES Oc1c(nc2ccc(cn2c1=O)N1CCOCC1)-c1nnc(Cc2ccc(F)cc2)s1 Show InChI InChI=1S/C21H18FN5O3S/c22-14-3-1-13(2-4-14)11-17-24-25-20(31-17)18-19(28)21(29)27-12-15(5-6-16(27)23-18)26-7-9-30-10-8-26/h1-6,12,28H,7-11H2	PDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	225	n/a	n/a	n/a	n/a	n/a	n/a
Avexa Ltd Curated by ChEMBL					Assay Description Inhibition of HIV-1 integrase-mediated 3'-processing and strand transfer activity				Bioorg Med Chem Lett 20: 5909-12 (2010) Article DOI: 10.1016/j.bmcl.2010.07.081 BindingDB Entry DOI: 10.7270/Q2XW4NNV
					More data for this Ligand-Target Pair