BDBM2744 4-Azido-3,3-dibromo-4,4-dimethoxy-5,5-bis(methoxycarbonyl)-1,1-diphenyl-1-butene::Alkenyldiarylmethane (ADAM) 9::Alkenyldiarylmethanes (ADAM) 9::methyl 5-{4-azido-1-[3-bromo-4-methoxy-5-(methoxycarbonyl)phenyl]but-1-en-1-yl}-3-bromo-2-methoxybenzoate

SMILES: [#6]-[#8]-[#6](=O)-c1cc(cc(Br)c1-[#8]-[#6])-[#6](=[#6]\[#6]-[#6]-[#7]=[N+]=[#7-])\c1cc(Br)c(-[#8]-[#6])c(c1)-[#6](=O)-[#8]-[#6]

InChI Key: InChIKey=DPRMKYXSLVKVEH-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 = 2744   

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)	BDBM2744 (4-Azido-3,3-dibromo-4,4-dimethoxy-5,5-bis(methoxyc...) Show SMILES [#6]-[#8]-[#6](=O)-c1cc(cc(Br)c1-[#8]-[#6])-[#6](=[#6]\[#6]-[#6]-[#7]=[N+]=[#7-])\c1cc(Br)c(-[#8]-[#6])c(c1)-[#6](=O)-[#8]-[#6] Show InChI InChI=1S/C22H21Br2N3O6/c1-30-19-15(21(28)32-3)8-12(10-17(19)23)14(6-5-7-26-27-25)13-9-16(22(29)33-4)20(31-2)18(24)11-13/h6,8-11H,5,7H2,1-4H3	PDB MMDB B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	9.40E+4	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
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