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BDBM90466 2-methyl-1-[2-(4-nitrophenoxy)ethyl]benzimidazole::MLS000693000::SMR000285690::cid_771866

SMILES: Cc1nc2ccccc2n1CCOc1ccc(cc1)[N+]([O-])=O

InChI Key: InChIKey=IELBMTPOEINEAN-UHFFFAOYSA-N

Data: 1 IC50  1 EC50

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 2 hits for monomerid = 90466   
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
corticotropin releasing factor-binding protein


(Homo sapiens (Human))
BDBM90466
PNG
(2-methyl-1-[2-(4-nitrophenoxy)ethyl]benzimidazole ...)
Show SMILES Cc1nc2ccccc2n1CCOc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O3/c1-12-17-15-4-2-3-5-16(15)18(12)10-11-22-14-8-6-13(7-9-14)19(20)21/h2-9H,10-11H2,1H3
KEGG

UniProtKB/SwissProt

GoogleScholar
Purchase

PC cid
PC sid
UniChem
PCBioAssay
n/an/a 972n/an/an/an/an/an/a



Burnham Center for Chemical Genomics

Curated by PubChem BioAssay




PubChem Bioassay (2012)


BindingDB Entry DOI: 10.7270/Q2NC5ZS3
More data for this
Ligand-Target Pair
corticotropin releasing factor-binding protein


(Homo sapiens (Human))
BDBM90466
PNG
(2-methyl-1-[2-(4-nitrophenoxy)ethyl]benzimidazole ...)
Show SMILES Cc1nc2ccccc2n1CCOc1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O3/c1-12-17-15-4-2-3-5-16(15)18(12)10-11-22-14-8-6-13(7-9-14)19(20)21/h2-9H,10-11H2,1H3
KEGG

UniProtKB/SwissProt

GoogleScholar
Purchase

PC cid
PC sid
UniChem
Article
PCBioAssay
n/an/an/an/a>5.30E+4n/an/an/an/a



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 (2012)


Article DOI: 10.1038/nchembio.2085
BindingDB Entry DOI: 10.7270/Q2VX0F3D
More data for this
Ligand-Target Pair