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SMILES: COc1ccc(Br)c(CN[C@H]2CCC[C@@H](C2)Nc2cc(C)c3ccc(OC)cc3n2)c1

InChI Key: InChIKey=VJSXNOMGSYDDRP-OALUTQOASA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50214048   
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
Melanin-concentrating hormone receptor 1


(Homo sapiens (Human))		BDBM50214048
PNG
((1S,3S)-N1-(2-bromo-5-methoxybenzyl)-N3-(7-methoxy...)
Show SMILES COc1ccc(Br)c(CN[C@H]2CCC[C@@H](C2)Nc2cc(C)c3ccc(OC)cc3n2)c1
Show InChI InChI=1S/C25H30BrN3O2/c1-16-11-25(29-24-14-21(31-3)7-9-22(16)24)28-19-6-4-5-18(13-19)27-15-17-12-20(30-2)8-10-23(17)26/h7-12,14,18-19,27H,4-6,13,15H2,1-3H3,(H,28,29)/t18-,19-/m0/s1
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Article
PubMed
n/an/a 28n/an/an/an/an/an/a



AstraZeneca R&D Mölndal

Curated by ChEMBL


Assay Description
Displacement of [125I]MCH from human MCHR1 expressed in HEK293 cells

Bioorg Med Chem Lett 17: 4232-41 (2007)


Article DOI: 10.1016/j.bmcl.2007.05.034
BindingDB Entry DOI: 10.7270/Q27W6BVC
More data for this
Ligand-Target Pair