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SMILES: NCCCC[C@H](N)C(=O)OC[C@H]1OC([C@H](O)[C@@H]1O)n1c(Br)nc2cc(Cl)c(Cl)cc12

InChI Key: InChIKey=PKSUULGPGVQTSW-IRFHGSPGSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50370605   
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
Solute carrier family 15 member 1


(Homo sapiens (Human))		BDBM50370605
PNG
(CHEMBL607956)
Show SMILES NCCCC[C@H](N)C(=O)OC[C@H]1OC([C@H](O)[C@@H]1O)n1c(Br)nc2cc(Cl)c(Cl)cc12 |r|
Show InChI InChI=1S/C18H23BrCl2N4O5/c19-18-24-11-5-8(20)9(21)6-12(11)25(18)16-15(27)14(26)13(30-16)7-29-17(28)10(23)3-1-2-4-22/h5-6,10,13-16,26-27H,1-4,7,22-23H2/t10-,13+,14+,15+,16?/m0/s1
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Similars
Article
PubMed
n/an/a 4.77E+5n/an/an/an/an/an/a



University of Michigan

Curated by ChEMBL


Assay Description
Inhibitory concentration against [3H]glycylsarcosine uptake in HeLa cells expressing human Intestinal peptide transporter PepT1

J Med Chem 48: 1274-7 (2005)


Article DOI: 10.1021/jm049450i
BindingDB Entry DOI: 10.7270/Q2348M46
More data for this
Ligand-Target Pair