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BDBM41979 6-[[4-(dimethylamino)phenyl]-(4-morpholinyl)methyl]-1,3-benzodioxol-5-ol::6-[[4-(dimethylamino)phenyl]-morpholin-4-yl-methyl]-1,3-benzodioxol-5-ol::6-[[4-(dimethylamino)phenyl]-morpholin-4-ylmethyl]-1,3-benzodioxol-5-ol::6-[[4-(dimethylamino)phenyl]-morpholino-methyl]sesamol::cid_339903

SMILES: CN(C)c1ccc(cc1)C(N1CCOCC1)c1cc2OCOc2cc1O

InChI Key: InChIKey=BRBNTWSWPLKACE-UHFFFAOYSA-N

Data: 1 IC50

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Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 41979   
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
mothers against decapentaplegic homolog 3


(Homo sapiens (Human))
BDBM41979
PNG
(6-[[4-(dimethylamino)phenyl]-(4-morpholinyl)methyl...)
Show SMILES CN(C)c1ccc(cc1)C(N1CCOCC1)c1cc2OCOc2cc1O
Show InChI InChI=1S/C20H24N2O4/c1-21(2)15-5-3-14(4-6-15)20(22-7-9-24-10-8-22)16-11-18-19(12-17(16)23)26-13-25-18/h3-6,11-12,20,23H,7-10,13H2,1-2H3
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MMDB

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Similars

PCBioAssay
n/an/a>4.00E+4n/an/an/an/an/an/a



Emory University

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: F.M. Hoffmann, University ...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q21R6NZ6
More data for this
Ligand-Target Pair