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Compound InformationSONAR Target prediction
Name:

Novel

Unique Identifier:LAT015G04
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C29H24O7
Molecular Weight:460.306 g/mol
X log p:33.735  (online calculus)
Lipinksi Failures1
TPSA52.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:7
Rotatable Bond Count:10
Canonical Smiles:OC(COc1ccc(c(O)c1)C(=O)c1ccccc1)COc1ccc(c(O)c1)C(=O)c1ccccc1

Found: 5 nonactive as graph: single | with analogs 1 2 3 4 5 Next >> 
Species: 4932
Condition: pdr18h
Replicates: 2
Raw OD Value: r im 0.6403±0.00480833
Normalized OD Score: sc h 1.0200±0.00210642
Z-Score: 0.7038±0.010395
p-Value: 0.481558
Z-Factor: -1.46863
Fitness Defect: 0.7307
Bioactivity Statement: Nonactive
Experimental Conditions
Library:LATCA
Plate Number and Position:15|G4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.10 Celcius
Date:2007-03-08 YYYY-MM-DD
Plate CH Control (+):0.0413±0.00249
Plate DMSO Control (-):0.6257±0.00813
Plate Z-Factor:0.9576
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DBLink | Rows returned: 2
1242235 [4-[3-(4-benzoyl-3-hydroxy-phenoxy)-2-hydroxy-propoxy]-2-hydroxy-phenyl]-phenyl-methanone
4028488 [4-[3-(4-benzoyl-3-hydroxy-phenoxy)-2-hydroxy-propoxy]phenyl]-(2-hydroxyphenyl)methanone

internal high similarity DBLink | Rows returned: 1
CB 5468086 1.0000

nonactive | Cluster 9214 | Additional Members: 5 | Rows returned: 2
Prest1270 0.42
SPE01500451 0.42

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