BDBM96739 3-[2-(4-chlorophenyl)ethanoylamino]-3-[4-[2-(2-fluorophenyl)ethylamino]-3-nitro-phenyl]propanamide::3-[[2-(4-chlorophenyl)-1-oxoethyl]amino]-3-[4-[2-(2-fluorophenyl)ethylamino]-3-nitrophenyl]propanamide::3-[[2-(4-chlorophenyl)acetyl]amino]-3-[4-[2-(2-fluorophenyl)ethylamino]-3-nitro-phenyl]propionamide::3-[[2-(4-chlorophenyl)acetyl]amino]-3-[4-[2-(2-fluorophenyl)ethylamino]-3-nitrophenyl]propanamide::MLS000420311::SMR000463258::cid_16746161

SMILES NC(=O)CC(NC(=O)Cc1ccc(Cl)cc1)c1ccc(NCCc2ccccc2F)c(c1)[N+]([O-])=O

InChI Key InChIKey=KHMNCBCKCFATAN-UHFFFAOYSA-N

Data  2 IC50  2 EC50

  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 4 hits for monomerid = 96739   

TargetTrace amine-associated receptor 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM96739(MLS000420311 | 3-[2-(4-chlorophenyl)ethanoylamino]...)
Affinity DataEC50:  9.91E+3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2013
Entry Details
PCBioAssay
TargetTrace amine-associated receptor 1(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM96739(MLS000420311 | 3-[2-(4-chlorophenyl)ethanoylamino]...)
Affinity DataIC50: 1.57E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2013
Entry Details
PCBioAssay
TargetGuanine nucleotide-binding protein subunit alpha-15(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM96739(MLS000420311 | 3-[2-(4-chlorophenyl)ethanoylamino]...)
Affinity DataIC50: 2.99E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2013
Entry Details
PCBioAssay
TargetGuanine nucleotide-binding protein subunit alpha-15(Human)
The Scripps Research Institute Molecular Screening Center

Curated by PubChem BioAssay
LigandPNGBDBM96739(MLS000420311 | 3-[2-(4-chlorophenyl)ethanoylamino]...)
Affinity DataEC50: >2.99E+4nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
6/21/2013
Entry Details
PCBioAssay