BDBM38526 MLS000030125::N-(2,5-Diethoxy-phenyl)-2-(3-methyl-4-m-tolyl-piperazin-1-yl)-acetamide::N-(2,5-diethoxyphenyl)-2-[3-methyl-4-(3-methylphenyl)-1-piperazinyl]acetamide;hydrochloride::N-(2,5-diethoxyphenyl)-2-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]acetamide;hydrochloride::N-(2,5-diethoxyphenyl)-2-[3-methyl-4-(3-methylphenyl)piperazin-1-yl]ethanamide;hydrochloride::N-(2,5-diethoxyphenyl)-2-[3-methyl-4-(m-tolyl)piperazino]acetamide;hydrochloride::SMR000000825::cid_6602695

SMILES: CCOc1ccc(OCC)c(NC(=O)CN2CCN(C(C)C2)c2cccc(C)c2)c1

InChI Key: InChIKey=BYTCDPQHSGCNDS-UHFFFAOYSA-N

Data: 3 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 3 hits for monomerid = 38526   

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
mevalonate kinase (Streptococcus pneumoniae D39)	BDBM38526 (MLS000030125 | N-(2,5-Diethoxy-phenyl)-2-(3-methyl...) Show SMILES CCOc1ccc(OCC)c(NC(=O)CN2CCN(C(C)C2)c2cccc(C)c2)c1 Show InChI InChI=1S/C24H33N3O3/c1-5-29-21-10-11-23(30-6-2)22(15-21)25-24(28)17-26-12-13-27(19(4)16-26)20-9-7-8-18(3)14-20/h7-11,14-15,19H,5-6,12-13,16-17H2,1-4H3,(H,25,28)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>1.00E+7	n/a	n/a	n/a	n/a	n/a	n/a
SRMLSC Curated by PubChem BioAssay					Assay Description Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...				PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q27P8WSS
					More data for this Ligand-Target Pair
mevalonate kinase (Streptococcus pneumoniae D39)	BDBM38526 (MLS000030125 | N-(2,5-Diethoxy-phenyl)-2-(3-methyl...) Show SMILES CCOc1ccc(OCC)c(NC(=O)CN2CCN(C(C)C2)c2cccc(C)c2)c1 Show InChI InChI=1S/C24H33N3O3/c1-5-29-21-10-11-23(30-6-2)22(15-21)25-24(28)17-26-12-13-27(19(4)16-26)20-9-7-8-18(3)14-20/h7-11,14-15,19H,5-6,12-13,16-17H2,1-4H3,(H,25,28)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	3.44E+6	n/a	n/a	n/a	n/a	n/a	n/a
SRMLSC Curated by PubChem BioAssay					Assay Description Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...				PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q2CF9NG2
					More data for this Ligand-Target Pair
mevalonate kinase (Streptococcus pneumoniae D39)	BDBM38526 (MLS000030125 | N-(2,5-Diethoxy-phenyl)-2-(3-methyl...) Show SMILES CCOc1ccc(OCC)c(NC(=O)CN2CCN(C(C)C2)c2cccc(C)c2)c1 Show InChI InChI=1S/C24H33N3O3/c1-5-29-21-10-11-23(30-6-2)22(15-21)25-24(28)17-26-12-13-27(19(4)16-26)20-9-7-8-18(3)14-20/h7-11,14-15,19H,5-6,12-13,16-17H2,1-4H3,(H,25,28)	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	>1.00E+7	n/a	n/a	n/a	n/a	n/a	n/a
SRMLSC Curated by PubChem BioAssay					Assay Description Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...				PubChem Bioassay (2007) BindingDB Entry DOI: 10.7270/Q23X852V
					More data for this Ligand-Target Pair