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SMILES: CN(C(=O)Oc1ccc(F)cc1)[C@@]1(C)CN(C[C@@H]1c1ccc(Cl)cc1)C(=O)c1ccc(cc1)N1CCCCC1=O

InChI Key: InChIKey=YOKUTCWHOIVMNE-JOMNFKBKSA-N

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 109730   
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
Neuromedin-K receptor


(Homo sapiens (Human))		BDBM109730
PNG
(US8618303, 20)
Show SMILES CN(C(=O)Oc1ccc(F)cc1)[C@@]1(C)CN(C[C@@H]1c1ccc(Cl)cc1)C(=O)c1ccc(cc1)N1CCCCC1=O |r|
Show InChI InChI=1S/C31H31ClFN3O4/c1-31(34(2)30(39)40-26-16-12-24(33)13-17-26)20-35(19-27(31)21-6-10-23(32)11-7-21)29(38)22-8-14-25(15-9-22)36-18-4-3-5-28(36)37/h6-17,27H,3-5,18-20H2,1-2H3/t27-,31+/m1/s1
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Similars
US Patent
 276n/an/an/an/an/an/an/an/a



Hoffmann-La Roche Inc.

US Patent


Assay Description
hNK3 receptor binding experiment were performed using [3H]SR142801 (Catalog No. TRK1035, specific activity: 74.0 Ci/mmol, Amersham, GE Healthcare UK ...

US Patent US8618303 (2013)


BindingDB Entry DOI: 10.7270/Q2TB15KK
More data for this
Ligand-Target Pair