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SMILES: COc1ccccc1NS(=O)(=O)c1cc(ccc1N=[NH+]Cc1c(C)[n-]c2ccccc12)[N+]([O-])=O

InChI Key: InChIKey=BHUOPUXRRKNPIC-UHFFFAOYSA-O

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Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 79791   
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
Tropomyosin alpha-1 chain


(Sus scrofa)		BDBM79791
PNG
(MLS002636842 | N-(2-methoxyphenyl)-2-[2-[(Z)-(2-me...)
Show SMILES COc1ccccc1NS(=O)(=O)c1cc(ccc1N=[NH+]Cc1c(C)[n-]c2ccccc12)[N+]([O-])=O |w:18.19|
Show InChI InChI=1S/C23H20N5O5S/c1-15-18(17-7-3-4-8-19(17)25-15)14-24-26-21-12-11-16(28(29)30)13-23(21)34(31,32)27-20-9-5-6-10-22(20)33-2/h3-13,27H,14H2,1-2H3/q-1/p+1
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
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PC cid
PC sid
UniChem

Similars
PCBioAssay
n/an/an/an/a 2.57E+3n/an/an/an/a



The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay


Assay Description
Source (MLPCN Center Name): The Scripps Research Institute Molecular Screening Center (SRIMSC) Affiliation: The Scripps Research Institute, TSRI Assa...

PubChem Bioassay (2011)


BindingDB Entry DOI: 10.7270/Q21N7ZKB
More data for this
Ligand-Target Pair