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Compound InformationSONAR Target prediction
Name:

ORSELLINIC ACID

Unique Identifier:SPE00300001
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:160.083 g/mol
X log p:3.494  (online calculus)
Lipinksi Failures0
TPSA17.07
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:1
Canonical Smiles:Cc1cc(O)cc(O)c1C(O)=O
Class:aromatic
Source:common lichen constituent

Found: 205 nonactive as graph: single | with analogs [1] << Back 191 192 193 194 195 196 197 198 199 200  Next >> [205]
Species: 4932
Condition: BY4743
Replicates: 2
Raw OD Value: r im 0.9890±0
Normalized OD Score: sc h 0.9700±0
Z-Score: -1.3463±0
p-Value: 0.178193
Z-Factor: -3.27852
Fitness Defect: 1.7249
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:16|H9
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2012-05-28 YYYY-MM-DD
Plate CH Control (+):0.095±0.00936
Plate DMSO Control (-):0.994±0.03203
Plate Z-Factor:0.8619
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DBLink | Rows returned: 2
68072 2,4-dihydroxy-6-methyl-benzoic acid
5460334 2,4-dihydroxy-6-methyl-benzoate

internal high similarity DBLink | Rows returned: 0

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

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