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BDBM41991 3-chloranyl-4-(dimethylamino)-1-(3-nitrophenyl)pyrrole-2,5-dione::3-chloro-4-(dimethylamino)-1-(3-nitrophenyl)-3-pyrroline-2,5-quinone::3-chloro-4-(dimethylamino)-1-(3-nitrophenyl)pyrrole-2,5-dione::MLS-0111744.0001::cid_16654771

SMILES: CN(C)C1=C(Cl)C(=O)N(C1=O)c1cccc(c1)[N+]([O-])=O

InChI Key: InChIKey=XYQRZBWTTOIECA-UHFFFAOYSA-N

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 = 41991   
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
Bfl-1


(Mus musculus (Mouse))
BDBM41991
PNG
(3-chloranyl-4-(dimethylamino)-1-(3-nitrophenyl)pyr...)
Show SMILES CN(C)C1=C(Cl)C(=O)N(C1=O)c1cccc(c1)[N+]([O-])=O |c:3|
Show InChI InChI=1S/C12H10ClN3O4/c1-14(2)10-9(13)11(17)15(12(10)18)7-4-3-5-8(6-7)16(19)20/h3-6H,1-2H3
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem

Similars

PCBioAssay
n/an/a 2.30E+3n/an/an/an/an/an/a



Sanford-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, C...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2X065GM
More data for this
Ligand-Target Pair