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SMILES OC(=O)c1cc2ccccc2c(Cc2c(O)c(cc3ccccc23)C(O)=O)c1O

InChI Key InChIKey=WLJNZVDCPSBLRP-UHFFFAOYSA-N

PDB links: 2 PDB IDs match this monomer.

  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 1 hit for monomerid = 38549   

TargetFlavin reductase (NADPH)(Homo sapiens)TBA
LigandPNGBDBM38549(2-[2-[4-[(4-chlorophenyl)-phenyl-methyl]piperazino...)copy SMILEScopy InChI
Affinity DataKd:  1.80E+3nMMore data for this Ligand-Target Pair

Activity Spreadsheet -- ITC Data from BindingDB

Found 1 hit for monomerid = 38549   

CellFlavin reductase (NADPH)(Homo sapiens)TBA
SyringePNGBDBM38549(2-[2-[4-[(4-chlorophenyl)-phenyl-methyl]piperazino...)
ITC DataΔG°: -7.83kcal/mole −TΔS°: -1.08kcal/mole ΔH°: -6.76kcal/mole logk: 5.58E+5
T: 25.00°C