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SMILES: CN(CC(=O)NCc1ccco1)S(=O)(=O)c1cccc2cccnc12

InChI Key: InChIKey=XNWHOOIAQRZATH-UHFFFAOYSA-N

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 = 79654   
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)		BDBM79654
PNG
(MLS000119318 | N-(2-furanylmethyl)-2-[methyl(8-qui...)
Show SMILES CN(CC(=O)NCc1ccco1)S(=O)(=O)c1cccc2cccnc12
Show InChI InChI=1S/C17H17N3O4S/c1-20(12-16(21)19-11-14-7-4-10-24-14)25(22,23)15-8-2-5-13-6-3-9-18-17(13)15/h2-10H,11-12H2,1H3,(H,19,21)
PDB
MMDB

KEGG

UniProtKB/SwissProt

B.MOAD
GoogleScholar
AffyNet 
PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>7.15E+4n/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