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BDBM50330665 2-(4-tert-Butylbenzyl)-3-[2-(4-acetoxy-2-bromo-5-methoxyphenyl)acetamido]propyl pivalate::CHEMBL1278013

SMILES: COc1cc(CC(=O)NCC(COC(=O)C(C)(C)C)Cc2ccc(cc2)C(C)(C)C)c(Br)cc1OC(C)=O

InChI Key: InChIKey=GYFNGHRIQTXBBM-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50330665   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Vanilloid receptor


(Rattus norvegicus (rat))
BDBM50330665
PNG
(2-(4-tert-Butylbenzyl)-3-[2-(4-acetoxy-2-bromo-5-m...)
Show SMILES COc1cc(CC(=O)NCC(COC(=O)C(C)(C)C)Cc2ccc(cc2)C(C)(C)C)c(Br)cc1OC(C)=O
Show InChI InChI=1S/C30H40BrNO6/c1-19(33)38-26-16-24(31)22(14-25(26)36-8)15-27(34)32-17-21(18-37-28(35)30(5,6)7)13-20-9-11-23(12-10-20)29(2,3)4/h9-12,14,16,21H,13,15,17-18H2,1-8H3,(H,32,34)
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PC sid
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Similars

Article
PubMed
34.9n/an/an/an/an/an/an/an/a



Seoul National University

Curated by ChEMBL


Assay Description
Displacement of [3H]RTX from rat TRPV1 expressed in CHO cells


Bioorg Med Chem 18: 8092-105 (2010)


Article DOI: 10.1016/j.bmc.2010.09.001
BindingDB Entry DOI: 10.7270/Q2Q81D98
More data for this
Ligand-Target Pair