BDBM2322 6-[1-(2,6-difluorophenyl)ethyl]-5-methyl-2-(methylsulfanyl)-3,4-dihydropyrimidin-4-one::S-DABO::thio-DABO 3r

SMILES: CSc1nc(C(C)c2c(F)cccc2F)c(C)c(=O)[nH]1

InChI Key: InChIKey=BJJHNPCGDRJFQW-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 = 2322   

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)	BDBM2322 (6-[1-(2,6-difluorophenyl)ethyl]-5-methyl-2-(methyl...) Show SMILES CSc1nc(C(C)c2c(F)cccc2F)c(C)c(=O)[nH]1 Show InChI InChI=1S/C14H14F2N2OS/c1-7(11-9(15)5-4-6-10(11)16)12-8(2)13(19)18-14(17-12)20-3/h4-7H,1-3H3,(H,17,18,19)	PDB MMDB B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Patents Similars	Article PubMed	n/a	n/a	20	n/a	n/a	n/a	n/a	7.8	37
Universita degli Studi di Roma La Sapienza					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 44: 2544-54 (2001) Article DOI: 10.1021/jm010853h BindingDB Entry DOI: 10.7270/Q2CN724V
					More data for this Ligand-Target Pair