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Compound InformationSONAR Target prediction
Name:

Novel

Unique Identifier:LAT017H02
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C17H18O4
Molecular Weight:268.18 g/mol
X log p:15.142  (online calculus)
Lipinksi Failures1
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:5
Canonical Smiles:CC(C)Oc1ccc(CC(=O)c2ccc(O)cc2O)cc1

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 0.6005±0.00339411
Normalized OD Score: sc h 0.8590±0.000597604
Z-Score: -5.9593±0.132074
p-Value: 0.00000000294614
Z-Factor: 0.629495
Fitness Defect: 19.6428
Bioactivity Statement: Active
Experimental Conditions
Library:LATCA
Plate Number and Position:17|H2
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.20 Celcius
Date:2007-03-08 YYYY-MM-DD
Plate CH Control (+):0.0402±0.00165
Plate DMSO Control (-):0.6852250000000001±0.01178
Plate Z-Factor:0.9505
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DBLink | Rows returned: 1
765925 1-(2,4-dihydroxyphenyl)-2-(4-propan-2-yloxyphenyl)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
LAT016D06 0.444444444444444
LAT016C09 0.363636363636364

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