BDBM50281329 CHEMBL97146::quinoline-2-carboxylic acid {(S)-1-[(1S,2S)-1-benzyl-3-(N-benzyl-N'-{(R)-3-methyl-2-[(quinoline-2-carbonyl)-amino]-butyryl}-hydrazino)-2-hydroxy-propylcarbamoyl]-2-methyl-propyl}-amide

SMILES CC(C)[C@H](NC(=O)c1ccc2ccccc2n1)C(=O)N[C@@H](Cc1ccccc1)[C@@H](O)CN(Cc1ccccc1)NC(=O)[C@H](NC(=O)c1ccc2ccccc2n1)C(C)C

InChI Key InChIKey=IBIIROXZGLAPGA-VEGQPAGDSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50281329   

TargetGag-Pol polyprotein [489-587](Human immunodeficiency virus type 1)
TBA

Curated by ChEMBL
LigandPNGBDBM50281329(CHEMBL97146 | quinoline-2-carboxylic acid {(S)-1-[...)
Affinity DataIC50:  65nMpH: 6.0Assay Description:In vitro inhibition of HIV-1 protease at pH 6 using 164 microM peptide substrateMore data for this Ligand-Target Pair
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