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BDBM95372 MLS000722032::SMR000236709::cid_16428461::sodium;2-[4-keto-2-[(N'E)-N'-[(E)-3-phenylprop-2-enylidene]hydrazino]-2-thiazolin-5-yl]acetate::sodium;2-[4-oxidanylidene-2-[(2E)-2-[(E)-3-phenylprop-2-enylidene]hydrazinyl]-1,3-thiazol-5-yl]ethanoate::sodium;2-[4-oxo-2-[(2E)-2-[(E)-3-phenylprop-2-enylidene]hydrazinyl]-1,3-thiazol-5-yl]acetate::sodium;2-[4-oxo-2-[(2E)-2-[(E)-3-phenylprop-2-enylidene]hydrazinyl]-5-thiazolyl]acetate

SMILES: Oc1nc(N=NC=CCc2ccccc2)sc1CC([O-])=O

InChI Key: InChIKey=BHWNUQMWDZCQQJ-UHFFFAOYSA-M

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 = 95372   
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
MSRA protein


(Bos taurus)
BDBM95372
PNG
(MLS000722032 | SMR000236709 | cid_16428461 | sodiu...)
Show SMILES Oc1nc(N=NC=CCc2ccccc2)sc1CC([O-])=O |w:4.3,7.7|
Show InChI InChI=1S/C14H13N3O3S/c18-12(19)9-11-13(20)16-14(21-11)17-15-8-4-7-10-5-2-1-3-6-10/h1-6,8,20H,7,9H2,(H,18,19)/p-1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/a 1.18E+5n/an/an/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay




PubChem Bioassay (2013)


BindingDB Entry DOI: 10.7270/Q2639NCQ
More data for this
Ligand-Target Pair