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Compound InformationSONAR Target prediction
Name:

Gallic Acid

Unique Identifier:LAT004F08
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C7H6O5
Molecular Weight:164.072 g/mol
X log p:4.357  (online calculus)
Lipinksi Failures0
TPSA17.07
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:5
Rotatable Bond Count:1
Canonical Smiles:OC(=O)c1cc(O)c(O)c(O)c1

Found: 5 nonactive as graph: single | with analogs << Back 1 2 3 4 5 Next >> 
Species: 4932
Condition: pdr24h
Replicates: 2
Raw OD Value: r im 0.6708±0.00954594
Normalized OD Score: sc h 0.9832±0.00147236
Z-Score: -0.6226±0.0969713
p-Value: 0.53453
Z-Factor: -9.49375
Fitness Defect: 0.6264
Bioactivity Statement: Nonactive
Experimental Conditions
Library:LATCA
Plate Number and Position:4|F8
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.10 Celcius
Date:2007-03-08 YYYY-MM-DD
Plate CH Control (+):0.040925±0.00269
Plate DMSO Control (-):0.6677249999999999±0.22269
Plate Z-Factor:-0.0779
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DBLink | Rows returned: 142 3 Next >> 
370 3,4,5-trihydroxybenzoic acid
67314 bismuth(+3) cation; 3,4,5-trihydroxybenzoate; hydroxide; iodide
86954 lithium 3,4,5-trihydroxybenzoate
92702 bismuth(+3) cation; 3,4,5-trihydroxybenzoate
159638 sodium 3,4,5-trihydroxybenzoate
4598586 3,4,5-trihydroxybenzoate

internal high similarity DBLink | Rows returned: 1
SPE00210369 1.0000

nonactive | Cluster 8976 | Additional Members: 4 | Rows returned: 2
LAT005D04 0.551724137931034
SPE00210369 0

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