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BDBM78907 3-bromanyl-N-[(2S)-1-[(3S,6R)-6-[(4-hydroxyphenyl)methyl]-3-(phenylmethyl)-2,3,5,6-tetrahydroimidazo[1,2-a]imidazol-7-yl]propan-2-yl]-4-methyl-benzamide::3-bromo-N-[(2S)-1-[(3S,6R)-6-[(4-hydroxyphenyl)methyl]-3-(phenylmethyl)-2,3,5,6-tetrahydroimidazo[1,2-a]imidazol-7-yl]propan-2-yl]-4-methylbenzamide::MLS000697919::N-[(1S)-2-[(3S,6R)-3-benzyl-6-(4-hydroxybenzyl)-2,3,5,6-tetrahydroimidaz[1,2-a]imidazol-7-yl]-1-methyl-ethyl]-3-bromo-4-methyl-benzamide::N-[(2S)-1-[(3S,6R)-3-benzyl-6-[(4-hydroxyphenyl)methyl]-2,3,5,6-tetrahydroimidazo[1,2-a]imidazol-7-yl]propan-2-yl]-3-bromo-4-methylbenzamide::SMR000386395::cid_16745339

SMILES: C[C@@H](CN1[C@H](Cc2ccc(O)cc2)CN2[C@@H](Cc3ccccc3)CN=C12)NC(=O)c1ccc(C)c(Br)c1

InChI Key: InChIKey=FYUVNCKPPAQUEO-OUIFVKKZSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 78907   
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
ubiquitin-conjugating enzyme E2 N


(Homo sapiens (Human))		BDBM78907
PNG
(3-bromanyl-N-[(2S)-1-[(3S,6R)-6-[(4-hydroxyphenyl)...)
Show SMILES C[C@@H](CN1[C@H](Cc2ccc(O)cc2)CN2[C@@H](Cc3ccccc3)CN=C12)NC(=O)c1ccc(C)c(Br)c1
Show InChI InChI=1S/C30H33BrN4O2/c1-20-8-11-24(16-28(20)31)29(37)33-21(2)18-34-26(15-23-9-12-27(36)13-10-23)19-35-25(17-32-30(34)35)14-22-6-4-3-5-7-22/h3-13,16,21,25-26,36H,14-15,17-19H2,1-2H3,(H,33,37)/t21-,25-,26+/m0/s1
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n/an/a>2.00E+4n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay


Assay Description
Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego CA...

PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q2X34VX0
More data for this
Ligand-Target Pair