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BDBM50187 MLS000571273::N'-[2-(4-methyl-1-piperazinyl)-5-nitrobenzylidene]-3-nitrobenzohydrazide::N-[[2-(4-methyl-1-piperazinyl)-5-nitrophenyl]methylideneamino]-3-nitrobenzamide::N-[[2-(4-methylpiperazin-1-yl)-5-nitro-phenyl]methylideneamino]-3-nitro-benzamide::N-[[2-(4-methylpiperazin-1-yl)-5-nitrophenyl]methylideneamino]-3-nitrobenzamide::N-[[2-(4-methylpiperazino)-5-nitro-benzylidene]amino]-3-nitro-benzamide::SMR000193640::cid_2876938

SMILES: CN1CCN(CC1)c1ccc(cc1[CH+][N-]NC(=O)c1cccc(c1)[N+]([O-])=O)[N+]([O-])=O

InChI Key: InChIKey=GUYMOPXWLZRBRY-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 = 50187   
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
Induced myeloid leukemia cell differentiation protein Mcl-1


(Homo sapiens (Human))
BDBM50187
PNG
(MLS000571273 | N'-[2-(4-methyl-1-piperazinyl)-...)
Show SMILES CN1CCN(CC1)c1ccc(cc1[CH+][N-]NC(=O)c1cccc(c1)[N+]([O-])=O)[N+]([O-])=O
Show InChI InChI=1S/C19H20N6O5/c1-22-7-9-23(10-8-22)18-6-5-17(25(29)30)12-15(18)13-20-21-19(26)14-3-2-4-16(11-14)24(27)28/h2-6,11-13H,7-10H2,1H3,(H,21,26)
PDB
MMDB

NCI pathway
KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 3.57E+3n/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: Nikolovska-Coleska, Univer...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q23X8539
More data for this
Ligand-Target Pair