BDBM50333228 CHEMBL1645270::N1-(((4S,5S)-5-(aminomethyl)-2,2-dimethyl-1,3-dioxolan-4-yl)methyl)-N2-(4-chloro-3-fluorophenyl)oxalamide

SMILES CC1(O[C@H]([C@@H](O1)CNC(=O)C(=O)Nc2ccc(c(c2)F)Cl)CN)C

InChI Key InChIKey=KUDYRECLZBUMDK-UHFFFAOYSA-N

Data  1 IC50  1 Kd

PDB links: 1 PDB ID matches this monomer.

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 50333228   

TargetEnvelope glycoprotein gp160(HIV-1)
Bryn Mawr College

Curated by ChEMBL
LigandPNGBDBM50333228(N1-(((4S,5S)-5-(aminomethyl)-2,2-dimethyl-1,3-diox...)
Affinity DataIC50: 7.66E+4nMAssay Description:Inhibition of HIV1 YU2 gp120 binding to CD4 expressing Cf2Th-CD4/CCR5 cells assessed as inhibition of viral infection after 48 hrsMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2011
Entry Details Article
PubMed
TargetEnvelope glycoprotein gp160(HIV-1)
Bryn Mawr College

Curated by ChEMBL
LigandPNGBDBM50333228(N1-(((4S,5S)-5-(aminomethyl)-2,2-dimethyl-1,3-diox...)
Affinity DataKd:  2.60E+3nMAssay Description:Binding affinity to HIV1 YU2 gp120 by isothermal titration calorimetry assayMore data for this Ligand-Target Pair
In Depth
Date in BDB:
8/21/2011
Entry Details Article
PubMed