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BDBM41191 MLS000029450::N-(3-Cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)-acetamide::N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)acetamide::N-(3-cyano-5,6,7,8-tetrahydro-4H-cyclohepta[b]thiophen-2-yl)ethanamide::SMR000010539::cid_645308

SMILES: CC(=O)Nc1sc2CCCCCc2c1C#N

InChI Key: InChIKey=QNTQEXMSNPNQKP-UHFFFAOYSA-N

Data: 1 IC50

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 41191   
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
RNA polymerase beta subunit (EC 2.7.7.6)


(Escherichia coli)
BDBM41191
PNG
(MLS000029450 | N-(3-Cyano-5,6,7,8-tetrahydro-4H-cy...)
Show SMILES CC(=O)Nc1sc2CCCCCc2c1C#N
Show InChI InChI=1S/C12H14N2OS/c1-8(15)14-12-10(7-13)9-5-3-2-4-6-11(9)16-12/h2-6H2,1H3,(H,14,15)
PDB
MMDB

UniProtKB/TrEMBL

B.MOAD
GoogleScholar
AffyNet 
Purchase

PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a>5.00E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Screening Center: Penn Center for Molecular Discovery Center Affiliation: University of Pennsylvania Network: Molecular Library Screening Center Netw...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q23N21T1
More data for this
Ligand-Target Pair