BDBM44879 1-(4-tert-butylphenoxy)-3-(1H-1,2,4-triazol-5-ylsulfanyl)propan-2-ol::1-(4-tert-butylphenoxy)-3-(1H-1,2,4-triazol-5-ylthio)-2-propanol::1-(4-tert-butylphenoxy)-3-(1H-1,2,4-triazol-5-ylthio)propan-2-ol::MLS000532470::SMR000137381::cid_2843367

SMILES CC(C)(C)c1ccc(OCC(O)CSc2nnc[nH]2)cc1

InChI Key InChIKey=GELABSIHEHAUTB-UHFFFAOYSA-N

Data  2 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 44879   

LigandPNGBDBM44879(MLS000532470 | SMR000137381 | 1-(4-tert-butylpheno...)
Affinity DataEC50:  4.74E+3nMAssay Description:Southern Research Molecular Libraries Screening Center (SRMLSC) Southern Research Institute (Birmingham, Alabama) NIH Molecular Libraries Screening C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/27/2011
Entry Details
PCBioAssay
TargetMatrix metalloproteinase-14 [1-36](Human)
Sanford-Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM44879(MLS000532470 | SMR000137381 | 1-(4-tert-butylpheno...)
Affinity DataEC50:  1.69E+4nMAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/30/2011
Entry Details
PCBioAssay