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BDBM50282936 CHEMBL59310::N-[1-(3,5-Dimethyl-benzyloxymethyl)-2,2-diphenyl-ethyl]-acetamide

SMILES: CC(=O)NC(COCc1cc(C)cc(C)c1)C(c1ccccc1)c1ccccc1

InChI Key: InChIKey=ADILVWNDEWPECX-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50282936   
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
Neurokinin 1 receptor


(Homo sapiens (Human))
BDBM50282936
PNG
(CHEMBL59310 | N-[1-(3,5-Dimethyl-benzyloxymethyl)-...)
Show SMILES CC(=O)NC(COCc1cc(C)cc(C)c1)C(c1ccccc1)c1ccccc1
Show InChI InChI=1S/C26H29NO2/c1-19-14-20(2)16-22(15-19)17-29-18-25(27-21(3)28)26(23-10-6-4-7-11-23)24-12-8-5-9-13-24/h4-16,25-26H,17-18H2,1-3H3,(H,27,28)
PDB
MMDB

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Similars

Article
n/an/a 21n/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity of the compound towards human Tachykinin receptor 1 expressed in CHO cells by the displacement of [125 I] substance P


Bioorg Med Chem Lett 4: 1903-1908 (1994)


Article DOI: 10.1016/S0960-894X(01)80531-X
BindingDB Entry DOI: 10.7270/Q2NK3DZ1
More data for this
Ligand-Target Pair