Marvin 2D Structure

The following exact ligands are found in BindingDB

Wt: 397.3 BDBM95197

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB (change energy unit to kcal/mol)

Found 1 hit in this display   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kJ/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
ADP-ribosylation factor GTPase-activating protein 1 (Rattus norvegicus)	BDBM95197 (5-({4-nitro-1H-pyrazol-1-yl}methyl)-N'-(4-prop...) Show SMILES CCCOc1ccc(\C=N\NC(=O)c2ccc(Cn3cc(cn3)[N+]([O-])=O)o2)cc1 Show InChI InChI=1S/C19H19N5O5/c1-2-9-28-16-5-3-14(4-6-16)10-20-22-19(25)18-8-7-17(29-18)13-23-12-15(11-21-23)24(26)27/h3-8,10-12H,2,9,13H2,1H3,(H,22,25)/b20-10+	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	PC cid PC sid UniChem Similars	PCBioAssay	n/a	n/a	4.90E+4	n/a	n/a	n/a	n/a	n/a	n/a
The Scripps Research Institute Molecular Screening Center Curated by PubChem BioAssay									PubChem Bioassay (2012) BindingDB Entry DOI: 10.7270/Q2Q52N82
					More data for this Ligand-Target Pair