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BDBM50331757 CHEMBL1288519::methyl 3,5-bis(trifluoromethyl)benzyl((5'-tert-butyl-2'-methoxy-4-(trifluoromethyl)biphenyl-2-yl)methyl)carbamate

SMILES: COC(=O)N(Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1cc(ccc1-c1cc(ccc1OC)C(C)(C)C)C(F)(F)F

InChI Key: InChIKey=MKKDOYAKQUWGKD-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50331757   
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
Cholesteryl ester transfer protein


(Homo sapiens (Human))
BDBM50331757
PNG
(CHEMBL1288519 | methyl 3,5-bis(trifluoromethyl)ben...)
Show SMILES COC(=O)N(Cc1cc(cc(c1)C(F)(F)F)C(F)(F)F)Cc1cc(ccc1-c1cc(ccc1OC)C(C)(C)C)C(F)(F)F
Show InChI InChI=1S/C30H28F9NO3/c1-27(2,3)19-7-9-25(42-4)24(14-19)23-8-6-20(28(31,32)33)12-18(23)16-40(26(41)43-5)15-17-10-21(29(34,35)36)13-22(11-17)30(37,38)39/h6-14H,15-16H2,1-5H3
PDB
MMDB

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PC sid
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Similars

Article
PubMed
n/an/a 2.59E+3n/an/an/an/an/an/a



Merck Sharp& Dohme Corp.

Curated by ChEMBL


Assay Description
Inhibition of CETP-mediated neutral lipid transfer by fluorometric analysis


Bioorg Med Chem Lett 20: 7469-72 (2010)


Article DOI: 10.1016/j.bmcl.2010.10.019
BindingDB Entry DOI: 10.7270/Q2FF3SMV
More data for this
Ligand-Target Pair