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BDBM50060768 10-imino(4,5-dihydro-1H-2-imidazolamine)methyl-9-anthrylmethan-(4,5-dihydro-1H-2-imidazolamine)imine::9,10-Anthracenedicarboxaldehyde Bis(2-imidazolin-2-yl-hydrazone)::9,10-anthracenedicarboxaldehyde Bis[(4,5-dihydro-1H-imidazol-2yl)hydrazone)::CHEMBL25336::N-Anthracen-9-yl methylene N'-[(bis)4,5-dihydro-1H-imidazole-2-yl)-hydrazine::N-Anthracen-bis-9,10-ylmethylene-N'-(4,5-dihydro-1H-imidazol-2-yl)-hydrazine(bisantrene)::NSC-337766::anthracene-9,10 bis-carbaldehyde 4,5-dihydro-1H-imidazol-2-ylhydrazone::x N-4,5-dihydro-1H-2-imidazolamine-10-iminomethyl-9-anthrylmethanimine-4,5-dihydro-1H-2-imidazolamine (Bisantrene)

SMILES: C1CN=C(NN=Cc2c3ccccc3c(C=NNC3=NCCN3)c3ccccc23)N1

InChI Key: InChIKey=NJSMWLQOCQIOPE-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50060768   
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
NAD(P)H dehydrogenase [quinone] 1


(Homo sapiens (Human))
BDBM50060768
PNG
(10-imino(4,5-dihydro-1H-2-imidazolamine)methyl-9-a...)
Show SMILES C1CN=C(NN=Cc2c3ccccc3c(C=NNC3=NCCN3)c3ccccc23)N1 |w:5.4,16.17,t:2,19|
Show InChI InChI=1S/C22H22N8/c1-2-6-16-15(5-1)19(13-27-29-21-23-9-10-24-21)17-7-3-4-8-18(17)20(16)14-28-30-22-25-11-12-26-22/h1-8,13-14H,9-12H2,(H2,23,24,29)(H2,25,26,30)
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MMDB

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Article
PubMed
n/an/a 2.50E+4n/an/an/an/an/an/a



University of Manchester

Curated by ChEMBL


Assay Description
Inhibition of human recombinant NQO1


Bioorg Med Chem Lett 16: 6246-54 (2006)


Article DOI: 10.1016/j.bmcl.2006.09.015
BindingDB Entry DOI: 10.7270/Q2V988WG
More data for this
Ligand-Target Pair