BDBM45742 1-(2,2-dimethyl-5-phenylazanyl-1,3,4-thiadiazol-3-yl)-2,2-dimethyl-propan-1-one::1-(5-anilino-2,2-dimethyl-1,3,4-thiadiazol-3-yl)-2,2-dimethyl-1-propanone::1-(5-anilino-2,2-dimethyl-1,3,4-thiadiazol-3-yl)-2,2-dimethyl-propan-1-one::1-(5-anilino-2,2-dimethyl-1,3,4-thiadiazol-3-yl)-2,2-dimethylpropan-1-one::1-(5-anilino-2,2-dimethyl-2,3-dihydro-1,3,4-thiadiazol-3-yl)-2,2-dimethylpropan-1-one::MLS000861887::SMR000460671::cid_2732978

SMILES CC(C)(C)C(=O)N1N=C(Nc2ccccc2)SC1(C)C

InChI Key InChIKey=OICNYDIYRIZPPR-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 45742   

TargetCoagulation factor XII(Human)
Pcmd

Curated by PubChem BioAssay
LigandPNGBDBM45742(MLS000861887 | cid_2732978 | 1-(2,2-dimethyl-5-phe...)
Affinity DataIC50: 5.00E+4nMAssay Description:Molecular Library Screening Center Network (MLSCN) Penn Center for Molecular Discovery (PCMD) Assay Provider: Scott L. Diamond, University of Pennsy...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/27/2011
Entry Details
PCBioAssay