BDBM20333 1-[(4-tert-butylphenyl)methyl]-3-[1-(4-methanesulfonamido-3-methoxyphenyl)cyclopropyl]thiourea::thiourea analogue, 61

SMILES COc1cc(ccc1NS(C)(=O)=O)C1(CC1)NC(=S)NCc1ccc(cc1)C(C)(C)C

InChI Key InChIKey=DNPKVROEPMZSJT-UHFFFAOYSA-N

Data  1 KI  1 EC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 20333   

LigandPNGBDBM20333(1-[(4-tert-butylphenyl)methyl]-3-[1-(4-methanesulf...)
Affinity DataKi:  370nM ΔG°:  -9.12kcal/mole EC50:  243nMpH: 7.4 T: 2°CAssay Description:Binding assay mixtures were set up and contained [3H] RTX, various concentrations of competing ligands, and rVR1-transfected CHO cells. Nonspecific b...More data for this Ligand-Target Pair
In Depth
Date in BDB:
2/11/2008
Entry Details Article
PubMed