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Compound InformationSONAR Target prediction
Name:

Novel

Unique Identifier:LAT016D06
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C14ClH11O3
Molecular Weight:251.601 g/mol
X log p:15.477  (online calculus)
Lipinksi Failures1
TPSA17.07
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:3
Canonical Smiles:Oc1ccc(c(O)c1)C(=O)Cc1cccc(Cl)c1

Found: 4 active | as graph: single | with analogs << Back 1 2 3 4 Next >> 
Species: 4932
Condition: pdr24h
Replicates: 2
Raw OD Value: r im 0.4129±0.185474
Normalized OD Score: sc h 0.5814±0.257894
Z-Score: -17.7599±10.6474
p-Value: 7.1943e-25
Z-Factor: -1.01839
Fitness Defect: 55.5913
Bioactivity Statement: Active
Experimental Conditions
Library:LATCA
Plate Number and Position:16|D6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.20 Celcius
Date:2007-03-08 YYYY-MM-DD
Plate CH Control (+):0.042425±0.00301
Plate DMSO Control (-):0.69285±0.01648
Plate Z-Factor:0.9190
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DBLink | Rows returned: 2
689037 2-(3-chlorophenyl)-1-(2,4,6-trihydroxyphenyl)ethanone
729356 2-(3-chlorophenyl)-1-(2,4-dihydroxyphenyl)ethanone

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 16963 | Additional Members: 14 | Rows returned: 92 Next >> 
LAT017G05 0.517241379310345
LAT015C09 0.490566037735849
SPE00100616 0.462962962962963
LAT017D05 0.454545454545455
LAT016C09 0.363636363636364
LAT016E11 0.306122448979592

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