BDBM75754 (4-methylphenyl)[(5-nitro-2-thienyl)methyl]amine::(5-nitro-2-thienyl)methyl-(p-tolyl)amine::4-methyl-N-[(5-nitro-2-thiophenyl)methyl]aniline::4-methyl-N-[(5-nitrothiophen-2-yl)methyl]aniline::MLS000974586::SMR000496479::cid_784457

SMILES: Cc1ccc(NCc2ccc(s2)[N+]([O-])=O)cc1

InChI Key: InChIKey=REJVHXYMOQINDA-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 = 75754   

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
Intestinal alkaline phosphatase (Homo sapiens (Human))	BDBM75754 ((4-methylphenyl)[(5-nitro-2-thienyl)methyl]amine |...) Show SMILES Cc1ccc(NCc2ccc(s2)[N+]([O-])=O)cc1 Show InChI InChI=1S/C12H12N2O2S/c1-9-2-4-10(5-3-9)13-8-11-6-7-12(17-11)14(15)16/h2-7,13H,8H2,1H3	PDB MMDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>1.00E+5	n/a	n/a	n/a	n/a	n/a	n/a
Burnham Center for Chemical Genomics Curated by PubChem BioAssay					Assay Description Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...				PubChem Bioassay (2010) BindingDB Entry DOI: 10.7270/Q2RV0M5R
					More data for this Ligand-Target Pair