BDBM50028 4-[2-[2-[butyl(ethyl)amino]ethylamino]-3,4-diketo-cyclobuten-1-yl]piperazine-1-carboxylic acid ethyl ester::4-[2-[2-[butyl(ethyl)amino]ethylamino]-3,4-dioxo-1-cyclobutenyl]-1-piperazinecarboxylic acid ethyl ester::MLS000093371::SMR000028989::cid_3235628::ethyl 4-[2-({2-[butyl(ethyl)amino]ethyl}amino)-3,4-dioxocyclobut-1-en-1-yl]piperazine-1-carboxylate::ethyl 4-[2-[2-[butyl(ethyl)amino]ethylamino]-3,4-bis(oxidanylidene)cyclobuten-1-yl]piperazine-1-carboxylate::ethyl 4-[2-[2-[butyl(ethyl)amino]ethylamino]-3,4-dioxocyclobuten-1-yl]piperazine-1-carboxylate

SMILES: CCCCN(CC)CCNc1c(N2CCN(CC2)C(=O)OCC)c(=O)c1=O

InChI Key: InChIKey=FDLMAQOWHDMLEL-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 = 50028   

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
Induced myeloid leukemia cell differentiation protein Mcl-1 (Homo sapiens (Human))	BDBM50028 (4-[2-[2-[butyl(ethyl)amino]ethylamino]-3,4-diketo-...) Show SMILES CCCCN(CC)CCNc1c(N2CCN(CC2)C(=O)OCC)c(=O)c1=O Show InChI InChI=1S/C19H32N4O4/c1-4-7-9-21(5-2)10-8-20-15-16(18(25)17(15)24)22-11-13-23(14-12-22)19(26)27-6-3/h20H,4-14H2,1-3H3	PDB MMDB NCI pathway KEGG UniProtKB/SwissProt B.MOAD antibodypedia GoogleScholar AffyNet	Purchase PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	433	n/a	n/a	n/a	n/a	n/a	n/a
Emory University Molecular Libraries Screening Center Curated by PubChem BioAssay					Assay Description NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Nikolovska-Coleska, Univer...				PubChem Bioassay (2008) BindingDB Entry DOI: 10.7270/Q23X8539
					More data for this Ligand-Target Pair