BDBM80378 3-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)sulfanyl]-N-phenylpropanamide::3-[(5-benzyl-4-methyl-1,2,4-triazol-3-yl)thio]-N-phenyl-propionamide::3-[(5-benzyl-4-methyl-4H-1,2,4-triazol-3-yl)thio]-N-phenylpropanamide::3-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]sulfanyl]-N-phenyl-propanamide::3-[[4-methyl-5-(phenylmethyl)-1,2,4-triazol-3-yl]thio]-N-phenylpropanamide::MLS000052663::SMR000082347::cid_2237442

SMILES Cn1c(Cc2ccccc2)nnc1SCCC(=O)Nc1ccccc1

InChI Key InChIKey=JCTOJZDTUSLUGV-UHFFFAOYSA-N

Data  2 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 80378   

TargetDNA dC->dU-editing enzyme APOBEC-3A(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM80378(cid_2237442 | 3-[[4-methyl-5-(phenylmethyl)-1,2,4-...)
Affinity DataIC50: 2.03E+3nMT: 2°CAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/3/2011
Entry Details
PCBioAssay
TargetDNA dC->dU-editing enzyme APOBEC-3G(Human)
Burnham Center For Chemical Genomics

Curated by PubChem BioAssay
LigandPNGBDBM80378(cid_2237442 | 3-[[4-methyl-5-(phenylmethyl)-1,2,4-...)
Affinity DataIC50: 4.55E+3nMT: 2°CAssay Description:Data Source: Sanford-Burnham Center for Chemical Genomics (SBCCG) Source Affiliation: Sanford-Burnham Medical Research Institute (SBMRI, San Diego, C...More data for this Ligand-Target Pair
In Depth
Date in BDB:
8/3/2011
Entry Details
PCBioAssay