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Compound InformationSONAR Target prediction
Name:

3`,4`-Dichlorobenzamil

Unique Identifier:LOPAC 00857
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C13Cl4H13N7O
Molecular Weight:411.996 g/mol
X log p:5.411  (online calculus)
Lipinksi Failures1
TPSA41.79
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:8
Rotatable Bond Count:6
Canonical Smiles:Cl.Nc1nc(N)c(nc1Cl)C(=O)NC(=N)NCc1ccc(Cl)c(Cl)c1
Class:Ion Pump
Action:Inhibitor
Selectivity:Na+/Ca2+ exchanger

Found: 24 nonactive as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [24]
Species: 4932
Condition: SMI1
Replicates: 2
Raw OD Value: r im 0.7270±0.0019799
Normalized OD Score: sc h 1.0112±0.0189468
Z-Score: 0.2856±0.494744
p-Value: 0.736964
Z-Factor: -5.06313
Fitness Defect: 0.3052
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:6|B4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.10 Celcius
Date:2005-11-15 YYYY-MM-DD
Plate CH Control (+):0.038525000000000004±0.00122
Plate DMSO Control (-):0.7283±0.03675
Plate Z-Factor:0.8247
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 4060 | Additional Members: 8 | Rows returned: 72 Next >> 
SPE01504215 0.462962962962963
LAT002H09 0.462962962962963
LOPAC 00229 0.408163265306122
SPE01503999 0.369565217391304
SPE01500112 0
Prest15 0

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