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BDBM152795 4-((4-(2-chlorophenyl)piperazin-1-yl)sulfonyl)-1,3-Dimethoxy-6-methyl-9H-xanthen-9-one (2e)

SMILES: COc1cc(OC)c2c(oc3cc(C)ccc3c2=O)c1S(=O)(=O)N1CCN(CC1)c1ccccc1Cl

InChI Key: InChIKey=UTUBXMVMIPAGNN-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 152795   
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
Acyl-CoA: cholesterol acyltransferase (ACAT)


(Homo sapiens (Human))
BDBM152795
PNG
(4-((4-(2-chlorophenyl)piperazin-1-yl)sulfonyl)-1,3...)
Show SMILES COc1cc(OC)c2c(oc3cc(C)ccc3c2=O)c1S(=O)(=O)N1CCN(CC1)c1ccccc1Cl
Show InChI InChI=1S/C26H25ClN2O6S/c1-16-8-9-17-20(14-16)35-25-23(24(17)30)21(33-2)15-22(34-3)26(25)36(31,32)29-12-10-28(11-13-29)19-7-5-4-6-18(19)27/h4-9,14-15H,10-13H2,1-3H3
PDB

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PC sid
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Similars

Article
PubMed
n/an/a 5.57E+3n/an/an/an/an/an/a



Second Military Medical University



Assay Description
HepG2 cells were cultured in low-glucose DMEM supplement with 100 U/mL streptomycin and penicillin. Twenty thousand cells were plated per well on 96-...


Chem Biol Drug Des 85: 394-403 (2015)


Article DOI: 10.1111/cbdd.12419
BindingDB Entry DOI: 10.7270/Q28W3C16
More data for this
Ligand-Target Pair