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SMILES: OP(O)(=O)C(Nc1ncccc1OCc1ccccc1)P(O)(O)=O

InChI Key: InChIKey=OBNTVZHFJOSDTM-UHFFFAOYSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50422782   
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
Phosphotransferase


(Trypanosoma cruzi)		BDBM50422782
PNG
(CHEMBL52621)
Show SMILES OP(O)(=O)C(Nc1ncccc1OCc1ccccc1)P(O)(O)=O
Show InChI InChI=1S/C13H16N2O7P2/c16-23(17,18)13(24(19,20)21)15-12-11(7-4-8-14-12)22-9-10-5-2-1-3-6-10/h1-8,13H,9H2,(H,14,15)(H2,16,17,18)(H2,19,20,21)
UniProtKB/TrEMBL

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CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
n/an/a 3.31E+12n/an/an/an/an/an/a



University of Illinois at Urbana-Champaign

Curated by ChEMBL


Assay Description
Inhibitory activity against Trypanosoma cruzi hexokinase

J Med Chem 49: 215-23 (2006)


Article DOI: 10.1021/jm0582625
BindingDB Entry DOI: 10.7270/Q2BV7G6G
More data for this
Ligand-Target Pair