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BDBM50033813 1-Benzyl-3-(3,5-bis-trifluoromethyl-benzyl)-5-(1H-indol-3-ylmethyl)-imidazolidine-2,4-dione::CHEMBL427295

SMILES: Oc1c(Cc2c[nH]c3ccccc23)n(Cc2ccccc2)c(=O)n1Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F

InChI Key: InChIKey=CBAOJWSPVQYBKA-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50033813   
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))
BDBM50033813
PNG
(1-Benzyl-3-(3,5-bis-trifluoromethyl-benzyl)-5-(1H-...)
Show SMILES Oc1c(Cc2c[nH]c3ccccc23)n(Cc2ccccc2)c(=O)n1Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F
Show InChI InChI=1S/C28H21F6N3O2/c29-27(30,31)20-10-18(11-21(13-20)28(32,33)34)16-37-25(38)24(12-19-14-35-23-9-5-4-8-22(19)23)36(26(37)39)15-17-6-2-1-3-7-17/h1-11,13-14,35,38H,12,15-16H2
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MMDB

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PubMed
n/an/a 310n/an/an/an/an/an/a



Merck Sharp& Dohme Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity at human Tachykinin receptor 1 expressed in CHO cells by [125 I]Trp8-substance P displacement.


J Med Chem 38: 923-33 (1995)


BindingDB Entry DOI: 10.7270/Q25D8SG4
More data for this
Ligand-Target Pair