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BDBM50337406 (1S,2R)-N-benzyl-1-(3,4-dichlorophenyl)-N-methyl-2-((4-phenyl-4-ureidopiperidin-1-yl)methyl)cyclopropanecarboxamide::CHEMBL1682671

SMILES: CN(Cc1ccccc1)C(=O)[C@]1(C[C@H]1CN1CCC(CC1)(NC(N)=O)c1ccccc1)c1ccc(Cl)c(Cl)c1

InChI Key: InChIKey=FYWXEKFVHHPBEC-VVFBEHOQSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50337406   
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))
BDBM50337406
PNG
((1S,2R)-N-benzyl-1-(3,4-dichlorophenyl)-N-methyl-2...)
Show SMILES CN(Cc1ccccc1)C(=O)[C@]1(C[C@H]1CN1CCC(CC1)(NC(N)=O)c1ccccc1)c1ccc(Cl)c(Cl)c1 |r|
Show InChI InChI=1S/C31H34Cl2N4O2/c1-36(20-22-8-4-2-5-9-22)28(38)31(24-12-13-26(32)27(33)18-24)19-25(31)21-37-16-14-30(15-17-37,35-29(34)39)23-10-6-3-7-11-23/h2-13,18,25H,14-17,19-21H2,1H3,(H3,34,35,39)/t25-,31+/m0/s1
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Similars

Article
PubMed
12n/an/an/an/an/an/an/an/a



H. Lundbeck A/S

Curated by ChEMBL


Assay Description
Displacement of [3H]Lu AE93103 from human NK3 receptor expressed in BHK cells


Bioorg Med Chem Lett 21: 1498-501 (2011)


Article DOI: 10.1016/j.bmcl.2010.12.135
BindingDB Entry DOI: 10.7270/Q23J3D8R
More data for this
Ligand-Target Pair