BDBM36449 CID25181262::ZINC12596968, 13

SMILES: Cn1cc(C(=O)Nc2cccc(c2)-c2nn[n-]n2)c2ccccc12

InChI Key: InChIKey=PVDIUAVVEBMUKR-UHFFFAOYSA-M

Data: 1 KI

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 = 36449   

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 CTX-M-1 (Escherichia coli)	BDBM36449 (CID25181262 | ZINC12596968, 13) Show SMILES Cn1cc(C(=O)Nc2cccc(c2)-c2nn[n-]n2)c2ccccc12 Show InChI InChI=1S/C17H14N6O/c1-23-10-14(13-7-2-3-8-15(13)23)17(24)18-12-6-4-5-11(9-12)16-19-21-22-20-16/h2-10H,1H3,(H2,18,19,20,21,22,24)/p-1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	1.00E+4	n/a	n/a	n/a	n/a	n/a	n/a	7.0	n/a
University of California, San Francisco					Assay Description Class A Beta-lactamase CTX-M inhibition assay				Nat Chem Biol 5: 358-64 (2009) Article DOI: 10.1038/nchembio.155 BindingDB Entry DOI: 10.7270/Q24M92WZ
					More data for this Ligand-Target Pair