BDBM601 (2R,4S)-N-(2-{[(2R,4S)-5,5-dimethyl-2-[(R)-(1-phenylacetamido)[(pyridin-2-ylmethyl)carbamoyl]methyl]-1,3-thiazolidin-4-yl]formamido}ethyl)-5,5-dimethyl-2-[(R)-(1-phenylacetamido)[(pyridin-2-ylmethyl)carbamoyl]methyl]-1,3-thiazolidine-4-carboxamide::Penicillin Et(NH)2 Sym dimer::penicillin deriv. 14

SMILES [H][C@]1(N[C@@H](C(=O)NCCNC(=O)[C@@H]2N[C@]([H])(SC2(C)C)[C@H](NC(=O)Cc2ccccc2)C(=O)NCc2ccccn2)C(C)(C)S1)[C@H](NC(=O)Cc1ccccc1)C(=O)NCc1ccccn1

InChI Key InChIKey=ISGIGDDPEZVQPE-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 = 601   

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

LigandPNGBDBM601((2R,4S)-N-(2-{[(2R,4S)-5,5-dimethyl-2-[(R)-(1-phen...)
Affinity DataIC50: 11nMpH: 6.0 T: 2°CAssay Description:IC50 values were obtained by assaying the enzyme against the synthetic substrate peptide KQGTVSFNFPQIT, which was tritiated at the proline residue, a...More data for this Ligand-Target Pair
In Depth
Date in BDB:
5/11/2004
Entry Details Article
PubMed