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BDBM50192620 5,6-dichloro-N-(3-(4-methylpiperazin-1-yl)propyl)-N-((1R,3R,6R)-6-(3-(morpholinomethyl)phenyl)bicyclo[4.1.0]heptan-3-yl)-1H-benzo[d]imidazol-2-amine::CHEMBL410566

SMILES: CN1CCN(CCCN([C@@H]2CC[C@@]3(C[C@@H]3C2)c2cccc(CN3CCOCC3)c2)c2nc3cc(Cl)c(Cl)cc3[nH]2)CC1

InChI Key: InChIKey=LFKWTBBRONKEKP-CLTMYIMISA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50192620   
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


(Homo sapiens (Human))		BDBM50192620
PNG
(5,6-dichloro-N-(3-(4-methylpiperazin-1-yl)propyl)-...)
Show SMILES CN1CCN(CCCN([C@@H]2CC[C@@]3(C[C@@H]3C2)c2cccc(CN3CCOCC3)c2)c2nc3cc(Cl)c(Cl)cc3[nH]2)CC1
Show InChI InChI=1S/C33H44Cl2N6O/c1-38-10-12-39(13-11-38)8-3-9-41(32-36-30-20-28(34)29(35)21-31(30)37-32)27-6-7-33(22-26(33)19-27)25-5-2-4-24(18-25)23-40-14-16-42-17-15-40/h2,4-5,18,20-21,26-27H,3,6-17,19,22-23H2,1H3,(H,36,37)/t26-,27+,33+/m0/s1
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 14n/an/an/an/an/an/an/an/a



Schering-Plough Research Institute

Curated by ChEMBL


Assay Description
Binding activity against human MCH-R1

Bioorg Med Chem Lett 16: 5427-31 (2006)


Article DOI: 10.1016/j.bmcl.2006.07.058
BindingDB Entry DOI: 10.7270/Q228076K
More data for this
Ligand-Target Pair