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BDBM74293 MLS002181622::N-[3-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-3-keto-propyl]-2-methoxy-benzamide::N-[3-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-3-oxidanylidene-propyl]-2-methoxy-benzamide::N-[3-(2,3-dihydro-1,4-benzodioxin-3-ylmethylamino)-3-oxopropyl]-2-methoxybenzamide::SMR001270652::cid_25162247

SMILES: COc1ccccc1C(=O)NCCC(=O)NCC1COc2ccccc2O1

InChI Key: InChIKey=MOKZKGIEWRAGAL-UHFFFAOYSA-N

Data: 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 1 hit for monomerid = 74293   
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
LANA


(Human herpesvirus 8)
BDBM74293
PNG
(MLS002181622 | N-[3-(2,3-dihydro-1,4-benzodioxin-3...)
Show SMILES COc1ccccc1C(=O)NCCC(=O)NCC1COc2ccccc2O1
Show InChI InChI=1S/C20H22N2O5/c1-25-16-7-3-2-6-15(16)20(24)21-11-10-19(23)22-12-14-13-26-17-8-4-5-9-18(17)27-14/h2-9,14H,10-13H2,1H3,(H,21,24)(H,22,23)
PDB

KEGG

UniProtKB/SwissProt

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PC cid
PC sid
UniChem
PCBioAssay
n/an/an/an/a>7.50E+4n/an/an/an/a



Broad Institute

Curated by PubChem BioAssay


Assay Description
Primary Collaborators: Kenneth Kaye,Brigham & Womens,Boston MA,kkaye@rics.bwh.harvard.edu,617-525-4256 Chantal Beauchemin,Brigham & Womens,Boston MA,...


PubChem Bioassay (2010)


BindingDB Entry DOI: 10.7270/Q2HH6HHN
More data for this
Ligand-Target Pair