BDBM19248 (2S)-2-hydroxy-3-[(4-isothiocyanatophenyl)amino]-2-methyl-N-[4-nitro-3-(trifluoromethyl)phenyl]propanamide::arylisothiocyanato derivative, S-32

SMILES C[C@](O)(CNc1ccc(cc1)N=C=S)C(=O)Nc1ccc(c(c1)C(F)(F)F)[N+]([O-])=O

InChI Key InChIKey=JWQHOPISDLFXKQ-KRWDZBQOSA-N

Data  1 KI

  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 = 19248   

TargetAndrogen receptor(Rattus norvegicus (Rat))
University Of Tennessee Health Science Center

LigandPNGBDBM19248((2S)-2-hydroxy-3-[(4-isothiocyanatophenyl)amino]-2...)
Affinity DataKi:  21.4nM ΔG°:  -9.72kcal/molepH: 7.4 T: 2°CAssay Description:The Ki values were determined by the application of the Cheng-Prusoff equation: Ki = (IC50 x Kd)/(Kd+[L]) where [L] is the concentration of [3H]MIB (...More data for this Ligand-Target Pair
In DepthDetails ArticlePubMed