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BDBM56859 2-acetamido-3,3,3-trifluoro-2-[4-[(5-methyl-3-isoxazolyl)sulfamoyl]anilino]propanoic acid ethyl ester::2-acetamido-3,3,3-trifluoro-2-[4-[(5-methylisoxazol-3-yl)sulfamoyl]anilino]propionic acid ethyl ester::MLS000547529::SMR000113334::cid_536731::ethyl 2-(acetylamino)-3,3,3-trifluoro-2-(4-{[(5-methyl-3-isoxazolyl)amino]sulfonyl}anilino)propanoate::ethyl 2-acetamido-3,3,3-trifluoro-2-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]anilino]propanoate::ethyl 2-acetamido-3,3,3-tris(fluoranyl)-2-[[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]amino]propanoate

SMILES: CCOC(=O)C(NC(C)=O)(Nc1ccc(cc1)S(=O)(=O)Nc1cc(C)on1)C(F)(F)F

InChI Key: InChIKey=IEHOCILDLZERNJ-UHFFFAOYSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 56859   
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
DNA repair protein RAD51 homolog 1


(Homo sapiens (Human))
BDBM56859
PNG
(2-acetamido-3,3,3-trifluoro-2-[4-[(5-methyl-3-isox...)
Show SMILES CCOC(=O)C(NC(C)=O)(Nc1ccc(cc1)S(=O)(=O)Nc1cc(C)on1)C(F)(F)F
Show InChI InChI=1S/C17H19F3N4O6S/c1-4-29-15(26)16(17(18,19)20,21-11(3)25)22-12-5-7-13(8-6-12)31(27,28)24-14-9-10(2)30-23-14/h5-9,22H,4H2,1-3H3,(H,21,25)(H,23,24)
PDB
MMDB

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Similars

PCBioAssay
n/an/a 8.50E+4n/an/an/an/an/an/a



PCMD

Curated by PubChem BioAssay


Assay Description
Project Title: A screen for modulators of human Rad51, a key DNA repair protein Application Number: MH084119 Assay Submitter: Dr. Alex Mazin Submitte...


PubChem Bioassay (2008)


BindingDB Entry DOI: 10.7270/Q2BV7F1T
More data for this
Ligand-Target Pair