BDBM2758 8-chloro-6-[1-(8-chloro-2,2-dimethyl-4-oxo-2,4-dihydro-1,3-benzodioxin-6-yl)-4-hydroxybut-1-en-1-yl]-2,2-dimethyl-2,4-dihydro-1,3-benzodioxin-4-one::Alkenyldiarylmethane (ADAM) 34::Alkenyldiarylmethanes (ADAM) 34

SMILES: [#6]C1([#6])[#8]-[#6](=O)-c2cc(cc(Cl)c2-[#8]1)-[#6](=[#6]/[#6]-[#6]-[#8])\c1cc(Cl)c2-[#8]C([#6])([#6])[#8]-[#6](=O)-c2c1

InChI Key: InChIKey=HRXHLPPEUPOTST-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 = 2758   

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
HIV-1 Reverse Transcriptase (Human immunodeficiency virus type 1)	BDBM2758 (8-chloro-6-[1-(8-chloro-2,2-dimethyl-4-oxo-2,4-dih...) Show SMILES [#6]C1([#6])[#8]-[#6](=O)-c2cc(cc(Cl)c2-[#8]1)-[#6](=[#6]/[#6]-[#6]-[#8])\c1cc(Cl)c2-[#8]C([#6])([#6])[#8]-[#6](=O)-c2c1 Show InChI InChI=1S/C24H22Cl2O7/c1-23(2)30-19-15(21(28)32-23)8-12(10-17(19)25)14(6-5-7-27)13-9-16-20(18(26)11-13)31-24(3,4)33-22(16)29/h6,8-11,27H,5,7H2,1-4H3	PDB MMDB B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	7.9	n/a
Purdue University					Assay Description The IC50 of reverse transcriptase is the concentration that inhibits 50% of recombinant HIV-1 RT RNA-directed DNA polymerase activity in vitro.				J Med Chem 41: 2076-89 (1998) Article DOI: 10.1021/jm9800595 BindingDB Entry DOI: 10.7270/Q2251GC2
					More data for this Ligand-Target Pair