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BDBM55628 2-[[4-[benzyl(ethyl)amino]benzylidene]amino]guanidine::2-[[4-[benzyl(ethyl)amino]phenyl]methylideneamino]guanidine::2-[[4-[ethyl-(phenylmethyl)amino]phenyl]methylideneamino]guanidine::MLS000375196::SMR000254449::cid_2379188

SMILES: [#6]-[#6]-[#7](-[#6]-c1ccccc1)-c1ccc(-[#6]=[#7]\[#7]=[#6](\[#7])-[#7])cc1

InChI Key: InChIKey=SBDIXHSCQKEGEH-UDWIEESQSA-N

Data: 1 IC50

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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 = 55628   
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
neutrophil cytosolic factor 1


(Homo sapiens (Human))
BDBM55628
PNG
(2-[[4-[benzyl(ethyl)amino]benzylidene]amino]guanid...)
Show SMILES CCN(Cc1ccccc1)c1ccc(C=NN=C(N)N)cc1
Show InChI InChI=1S/C17H21N5/c1-2-22(13-15-6-4-3-5-7-15)16-10-8-14(9-11-16)12-20-21-17(18)19/h3-12H,2,13H2,1H3,(H4,18,19,21)/b20-12+
PDB
MMDB

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PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 1.96E+4n/an/an/an/an/an/a



Emory University

Curated by PubChem BioAssay


Assay Description
NIH Molecular Libraries Screening Centers Network [MLSCN] Emory Chemical Biology Discovery Center in MLSCN Assay provider: Susan Smith, Emory Univers...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2M90723
More data for this
Ligand-Target Pair