BDBM1938 (2S,3R)-2-({3-[1-(4-hydroxy-2-oxo-2H-chromen-3-yl)propyl]phenyl}formamido)-3-methyl-N-(pyridin-2-ylmethyl)pentanamide::3-[1-(4-Hydroxy-2-oxo-2H-1-benzopyran-3-yl)propyl]-N-[2-methyl-1-[[(2-pyridinylmethyl)amino]carbonyl]butyl]benzamide::Alternate Carboxamide-Containing Phenprocoumon deriv. XIX

SMILES CCC(C)[C@H](NC(=O)c1cccc(c1)C(CC)c1c(O)c2ccccc2oc1=O)C(=O)NCc1ccccn1

InChI Key InChIKey=QIHKVSBIWBQSSB-VUDGLICPSA-N

Data  1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 1938   

TargetDimer of Gag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
Upjohn

LigandPNGBDBM1938((2S,3R)-2-({3-[1-(4-hydroxy-2-oxo-2H-chromen-3-yl)...)
Show SMILES CCC(C)[C@H](NC(=O)c1cccc(c1)C(CC)c1c(O)c2ccccc2oc1=O)C(=O)NCc1ccccn1
Show InChI InChI=1S/C31H33N3O5/c1-4-19(3)27(30(37)33-18-22-13-8-9-16-32-22)34-29(36)21-12-10-11-20(17-21)23(5-2)26-28(35)24-14-6-7-15-25(24)39-31(26)38/h6-17,19,23,27,35H,4-5,18H2,1-3H3,(H,33,37)(H,34,36)/t19?,23?,27-/m0/s1
Affinity DataKi:  400nM ΔG°:  -8.63kcal/molepH: 5.0 T: 2°CAssay Description:HIV-1 protease was purified and refolded from E. coli inclusion bodies. The substrate used spans the p17-p24 processing site (R-V-S-Q-N-Y-P-I-V-Q-N-K...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid