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SMILES: c1ccc(cc1)-c1nn2c(nnc2s1)-c1cnccn1

InChI Key: InChIKey=HHUPYLMJHZKQNH-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50449133   
Target/Host
(Institution)		LigandTarget/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		pHTemp
°C
Xanthine dehydrogenase/oxidase


(Bos taurus (Bovine))		BDBM50449133
PNG
(CHEMBL3127139)
Show SMILES c1ccc(cc1)-c1nn2c(nnc2s1)-c1cnccn1
Show InChI InChI=1S/C13H8N6S/c1-2-4-9(5-3-1)12-18-19-11(16-17-13(19)20-12)10-8-14-6-7-15-10/h1-8H
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 79n/an/an/an/an/an/a



AstraZeneca

Curated by ChEMBL


Assay Description
Inhibition of bovine xanthine oxidase

Bioorg Med Chem Lett 24: 1315-21 (2014)


Article DOI: 10.1016/j.bmcl.2014.01.050
BindingDB Entry DOI: 10.7270/Q2V69M3N
More data for this
Ligand-Target Pair