BDBM50228802 CHEMBL89256

SMILES: CCOC(=O)N1C(C(C(=O)OCC)=C(C)N=C1N)c1cccc(c1)[N+]([O-])=O

InChI Key: InChIKey=CCSNTESBCKUCEA-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 = 50228802   

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
Voltage-gated L-type calcium channel (Homo sapiens (Human))	BDBM50228802 (CHEMBL89256) Show SMILES CCOC(=O)N1C(C(C(=O)OCC)=C(C)N=C1N)c1cccc(c1)[N+]([O-])=O |c:15,t:12| Show InChI InChI=1S/C17H20N4O6/c1-4-26-15(22)13-10(3)19-16(18)20(17(23)27-5-2)14(13)11-7-6-8-12(9-11)21(24)25/h6-9,14H,4-5H2,1-3H3,(H2,18,19)	PDB KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia antibodypedia antibodypedia antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	PubMed	n/a	n/a	160	n/a	n/a	n/a	n/a	n/a	n/a
Squibb Institute for Medical Research Curated by ChEMBL					Assay Description In vitro vasorelaxant activity (voltage-gated calcium channel blocking activity) was determined with potassium-depolarized rabbit thoracic aorta				J Med Chem 33: 2629-35 (1990) BindingDB Entry DOI: 10.7270/Q2XD13XV
					More data for this Ligand-Target Pair