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BDBM78067 (E)-3-[5-(1-azepanyl)-2-furanyl]-2-(3-fluorophenyl)-2-propenenitrile::(E)-3-[5-(azepan-1-yl)-2-furyl]-2-(3-fluorophenyl)acrylonitrile::(E)-3-[5-(azepan-1-yl)furan-2-yl]-2-(3-fluorophenyl)prop-2-enenitrile::3-[5-(1-azepanyl)-2-furyl]-2-(3-fluorophenyl)acrylonitrile::MLS000539028::SMR000144843::cid_2227134

SMILES: Fc1cccc(c1)C(=C/c1ccc(o1)N1CCCCCC1)\C#N

InChI Key: InChIKey=HQHQTIFNFOQLOP-SSZFMOIBSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 78067   
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
TPA: Essential protein of the mitochondrial intermembrane space


(Saccharomyces cerevisiae S288c)
BDBM78067
PNG
((E)-3-[5-(1-azepanyl)-2-furanyl]-2-(3-fluorophenyl...)
Show SMILES Fc1cccc(c1)C(=C/c1ccc(o1)N1CCCCCC1)\C#N
Show InChI InChI=1S/C19H19FN2O/c20-17-7-5-6-15(12-17)16(14-21)13-18-8-9-19(23-18)22-10-3-1-2-4-11-22/h5-9,12-13H,1-4,10-11H2/b16-13-
PDB
MMDB

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Similars

PCBioAssay
n/an/a 1.49E+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 (2010)


BindingDB Entry DOI: 10.7270/Q2F18X6W
More data for this
Ligand-Target Pair