BDBM50508782 CHEMBL3774725

SMILES: CCOC(=O)c1[nH]c2ccc(Cl)cc2c1C(SC)c1ccccc1

InChI Key: InChIKey=MDXWLYXNYPPKDZ-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 = 50508782   

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
Reverse transcriptase (Human immunodeficiency virus 1)	BDBM50508782 (CHEMBL3774725) Show SMILES CCOC(=O)c1[nH]c2ccc(Cl)cc2c1C(SC)c1ccccc1 Show InChI InChI=1S/C19H18ClNO2S/c1-3-23-19(22)17-16(14-11-13(20)9-10-15(14)21-17)18(24-2)12-7-5-4-6-8-12/h4-11,18,21H,3H2,1-2H3	PDB MMDB UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem	Article PubMed	n/a	n/a	39	n/a	n/a	n/a	n/a	n/a	n/a
Stellenbosch University Curated by ChEMBL					Assay Description Inhibition of wild-type HIV1 reverse transcriptase in HIV1 infected HEK293T cells harboring luciferase gene assessed as reduction in viral infection ...				ACS Med Chem Lett 10: 196-202 (2019) Article DOI: 10.1021/acsmedchemlett.8b00549
					More data for this Ligand-Target Pair