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BDBM60400 1-[4-[4-[(5-methyl-2-thienyl)methylamino]phenyl]piperazino]ethanone;hydrochloride::1-[4-[4-[(5-methyl-2-thiophenyl)methylamino]phenyl]-1-piperazinyl]ethanone;hydrochloride::1-[4-[4-[(5-methylthiophen-2-yl)methylamino]phenyl]piperazin-1-yl]ethanone;hydrochloride::MLS000120391::N-[4-(4-acetylpiperazin-1-yl)phenyl]-N-[(5-methylthien-2-yl)methyl]amine::SMR000102010::cid_6603583

SMILES: CC(=O)N1CCN(CC1)c1ccc(NCc2ccc(C)s2)cc1

InChI Key: InChIKey=NBTJKIFWVNMRTR-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 60400   
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
large T antigen


(Simian virus 40)
BDBM60400
PNG
(1-[4-[4-[(5-methyl-2-thienyl)methylamino]phenyl]pi...)
Show SMILES CC(=O)N1CCN(CC1)c1ccc(NCc2ccc(C)s2)cc1
Show InChI InChI=1S/C18H23N3OS/c1-14-3-8-18(23-14)13-19-16-4-6-17(7-5-16)21-11-9-20(10-12-21)15(2)22/h3-8,19H,9-13H2,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a 3.48E+3n/an/an/an/an/an/a



Southern Research Specialized Biocontainment Screening Center

Curated by PubChem BioAssay


Assay Description
A biochemical assay using the ADP-Hunter methodology, purified TAg, and ATP to identify compounds that inhibit the ATPase activity of Tag Southern Re...


Citation and Details
More data for this
Ligand-Target Pair