BDBM40466 1-[(4-ethyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-3,3-dimethyl-butan-2-one::1-[(4-ethyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulfanyl]-3,3-dimethylbutan-2-one::1-[[4-ethyl-5-(2-pyridinyl)-1,2,4-triazol-3-yl]thio]-3,3-dimethyl-2-butanone::1-[[4-ethyl-5-(2-pyridyl)-1,2,4-triazol-3-yl]thio]-3,3-dimethyl-butan-2-one::1-{[4-ethyl-5-(2-pyridinyl)-4H-1,2,4-triazol-3-yl]thio}-3,3-dimethyl-2-butanone::MLS000050871::SMR000078566::cid_936610

SMILES CCn1c(SCC(=O)C(C)(C)C)nnc1-c1ccccn1

InChI Key InChIKey=JRRCRKBDYZPBHT-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 40466   

TargetCollagenase 3(Homo sapiens (Human))
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM40466(1-[(4-ethyl-5-pyridin-2-yl-1,2,4-triazol-3-yl)sulf...)
Affinity DataIC50: >3.98E+4nMAssay Description:Source (MLSCN Center Name): The Scripps Research Institute Molecular Screening Center Center Affiliation: The Scripps Research Institute, TSRI Assay ...More data for this Ligand-Target Pair
In DepthDetails PCBioAssay