BDBM51953 4-(4-methoxyphenyl)-2-(4-methyl-1-piperazinyl)-6-(trifluoromethyl)pyrimidine::4-(4-methoxyphenyl)-2-(4-methylpiperazin-1-yl)-6-(trifluoromethyl)pyrimidine::4-(4-methoxyphenyl)-2-(4-methylpiperazino)-6-(trifluoromethyl)pyrimidine::MLS000044538::SMR000022315::cid_2985091

SMILES: COc1ccc(cc1)-c1cc(nc(n1)N1CCN(C)CC1)C(F)(F)F

InChI Key: InChIKey=IQADDSPWJZCIDP-UHFFFAOYSA-N

Data: 4 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 4 hits for monomerid = 51953   

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
Beta lactamase (Pseudomonas aeruginosa)	BDBM51953 (4-(4-methoxyphenyl)-2-(4-methyl-1-piperazinyl)-6-(...) Show SMILES COc1ccc(cc1)-c1cc(nc(n1)N1CCN(C)CC1)C(F)(F)F Show InChI InChI=1S/C17H19F3N4O/c1-23-7-9-24(10-8-23)16-21-14(11-15(22-16)17(18,19)20)12-3-5-13(25-2)6-4-12/h3-6,11H,7-10H2,1-2H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	5.96E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2X63KBQ
					More data for this Ligand-Target Pair
metallo-beta-lactamase IMP-1 (Pseudomonas aeruginosa)	BDBM51953 (4-(4-methoxyphenyl)-2-(4-methyl-1-piperazinyl)-6-(...) Show SMILES COc1ccc(cc1)-c1cc(nc(n1)N1CCN(C)CC1)C(F)(F)F Show InChI InChI=1S/C17H19F3N4O/c1-23-7-9-24(10-8-23)16-21-14(11-15(22-16)17(18,19)20)12-3-5-13(25-2)6-4-12/h3-6,11H,7-10H2,1-2H3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	5.96E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2J101MD
					More data for this Ligand-Target Pair
Beta lactamase (Pseudomonas aeruginosa)	BDBM51953 (4-(4-methoxyphenyl)-2-(4-methyl-1-piperazinyl)-6-(...) Show SMILES COc1ccc(cc1)-c1cc(nc(n1)N1CCN(C)CC1)C(F)(F)F Show InChI InChI=1S/C17H19F3N4O/c1-23-7-9-24(10-8-23)16-21-14(11-15(22-16)17(18,19)20)12-3-5-13(25-2)6-4-12/h3-6,11H,7-10H2,1-2H3	PDB MMDB KEGG UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	5.96E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2NS0S90
					More data for this Ligand-Target Pair
metallo-beta-lactamase IMP-1 (Pseudomonas aeruginosa)	BDBM51953 (4-(4-methoxyphenyl)-2-(4-methyl-1-piperazinyl)-6-(...) Show SMILES COc1ccc(cc1)-c1cc(nc(n1)N1CCN(C)CC1)C(F)(F)F Show InChI InChI=1S/C17H19F3N4O/c1-23-7-9-24(10-8-23)16-21-14(11-15(22-16)17(18,19)20)12-3-5-13(25-2)6-4-12/h3-6,11H,7-10H2,1-2H3	PDB MMDB UniProtKB/TrEMBL B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	5.96E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay					Assay Description Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Center Affiliation: The Scripps Research Institute (TS...				PubChem Bioassay (2009) BindingDB Entry DOI: 10.7270/Q2SF2TM0
					More data for this Ligand-Target Pair