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Compound InformationSONAR Target prediction
Name:

Orsellinic Acid, Ethyl Ester

Unique Identifier:LAT001D03
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C10H12O4
Molecular Weight:184.105 g/mol
X log p:4.757  (online calculus)
Lipinksi Failures0
TPSA26.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:3
Canonical Smiles:CCOC(=O)c1c(C)cc(O)cc1O

Found: 5 nonactive as graph: single | with analogs 2 3 4 5 Next >> 
Species: 4932
Condition: pdr18h
Replicates: 2
Raw OD Value: r im 0.6332±0.0225567
Normalized OD Score: sc h 1.0187±0.0207657
Z-Score: 0.6928±0.633711
p-Value: 0.530288
Z-Factor: -6.68342
Fitness Defect: 0.6343
Bioactivity Statement: Nonactive
Experimental Conditions
Library:LATCA
Plate Number and Position:1|D3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.90 Celcius
Date:2007-03-08 YYYY-MM-DD
Plate CH Control (+):0.040175±0.00183
Plate DMSO Control (-):0.629975±0.20881
Plate Z-Factor:-0.0737
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DBLink | Rows returned: 1
75653 ethyl 2,4-dihydroxy-6-methyl-benzoate

internal high similarity DBLink | Rows returned: 1
SPE00200002 1.0000

active | Cluster 13178 | Additional Members: 8 | Rows returned: 3
SPE00210072 0.478260869565217
SPE00200061 0.471698113207547
SPE00200002 0

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