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BDBM87565 (5Z)-5-[(5-bromanylthiophen-2-yl)methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione::(5Z)-5-[(5-bromo-2-thienyl)methylene]-1-methyl-2-thioxo-hexahydropyrimidine-4,6-quinone::(5Z)-5-[(5-bromo-2-thiophenyl)methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione::(5Z)-5-[(5-bromothiophen-2-yl)methylidene]-1-methyl-2-sulfanylidene-1,3-diazinane-4,6-dione::MLS001195205::SMR000503064::cid_1777233

SMILES: CN1C(=S)NC(=O)\C(=C\c2ccc(Br)s2)C1=O

InChI Key: InChIKey=DHXHBTASCMMTSD-XQRVVYSFSA-N

Data: 1 EC50

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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 = 87565   
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
Vma11p


(Saccharomyces cerevisiae S288c)
BDBM87565
PNG
((5Z)-5-[(5-bromanylthiophen-2-yl)methylidene]-1-me...)
Show SMILES CN1C(=S)NC(=O)\C(=C\c2ccc(Br)s2)C1=O
Show InChI InChI=1S/C10H7BrN2O2S2/c1-13-9(15)6(8(14)12-10(13)16)4-5-2-3-7(11)17-5/h2-4H,1H3,(H,12,14,16)/b6-4-
PDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem

Similars

Article
PCBioAssay
n/an/an/an/a 6.43E+3n/an/an/an/a



NMMLSC

Curated by PubChem BioAssay


Assay Description
University of New Mexico Assay Overview: Assay Support: 1 R03 DA031666-01A1 Project Title: Flow Cytometry HTS of Small Molecules that Regulate V-ATPa...


PubChem Bioassay (2012)


Article DOI: 10.1016/j.bioorg.2016.08.005
BindingDB Entry DOI: 10.7270/Q2MK6BGR
More data for this
Ligand-Target Pair