BDBM36442 CID7129233::ZINC04206703, 6

SMILES: O=C1N(CCc2nn[n-]n2)C(=O)c2ccccc12

InChI Key: InChIKey=JVMRTKQCRGGQIF-UHFFFAOYSA-N

Data: 2 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 2 hits for monomerid = 36442   

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)	BDBM36442 (CID7129233 | ZINC04206703, 6) Show SMILES O=C1N(CCc2nn[n-]n2)C(=O)c2ccccc12 Show InChI InChI=1S/C11H8N5O2/c17-10-7-3-1-2-4-8(7)11(18)16(10)6-5-9-12-14-15-13-9/h1-4H,5-6H2/q-1	PDB KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	1.94E+5	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
Beta-lactamase (Escherichia coli)	BDBM36442 (CID7129233 | ZINC04206703, 6) Show SMILES O=C1N(CCc2nn[n-]n2)C(=O)c2ccccc12 Show InChI InChI=1S/C11H8N5O2/c17-10-7-3-1-2-4-8(7)11(18)16(10)6-5-9-12-14-15-13-9/h1-4H,5-6H2/q-1	PDB MMDB KEGG UniProtKB/SwissProt B.MOAD DrugBank GoogleScholar AffyNet	Purchase PC cid PC sid UniChem	Article PubMed	3.30E+6	n/a	n/a	n/a	n/a	n/a	n/a	7.0	n/a
University of California, San Francisco					Assay Description Class C Beta-lactamase AmpC 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