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BDBM45342 MLS000054781::N-(4-methoxy-1,3-benzothiazol-2-yl)-4-(4-morpholinylsulfonyl)benzamide::N-(4-methoxy-1,3-benzothiazol-2-yl)-4-morpholin-4-ylsulfonyl-benzamide::N-(4-methoxy-1,3-benzothiazol-2-yl)-4-morpholin-4-ylsulfonylbenzamide::N-(4-methoxy-1,3-benzothiazol-2-yl)-4-morpholinosulfonyl-benzamide::SMR000060692::cid_1548582

SMILES: COc1cccc2sc(NC(=O)c3ccc(cc3)S(=O)(=O)N3CCOCC3)nc12

InChI Key: InChIKey=FZNKDVDFHGPRQZ-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 = 45342   
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
Factor XIIa


(Homo sapiens (Human))
BDBM45342
PNG
(MLS000054781 | N-(4-methoxy-1,3-benzothiazol-2-yl)...)
Show SMILES COc1cccc2sc(NC(=O)c3ccc(cc3)S(=O)(=O)N3CCOCC3)nc12
Show InChI InChI=1S/C19H19N3O5S2/c1-26-15-3-2-4-16-17(15)20-19(28-16)21-18(23)13-5-7-14(8-6-13)29(24,25)22-9-11-27-12-10-22/h2-8H,9-12H2,1H3,(H,20,21,23)
PDB

UniProtKB/SwissProt

GoogleScholar
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PC cid
PC sid
UniChem
PCBioAssay
n/an/a>5.00E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q21G0JQS
More data for this
Ligand-Target Pair