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Compound InformationSONAR Target prediction
Name:

HEXYLRESORCINOL

Unique Identifier:SPE01500330
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:176.127 g/mol
X log p:6.379  (online calculus)
Lipinksi Failures1
TPSA0
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:2
Rotatable Bond Count:5
Canonical Smiles:CCCCCCc1ccc(O)cc1O
Source:synthetic
Therapeutics:anthelmintic, topical antiseptic

Found: 192 active | as graph: single | with analogs [1] << Back 171 172 173 174 175 176 177 178 179 180  Next >> [192]
Species: 4932
Condition: LAT1
Replicates: 2
Raw OD Value: r im 0.4295±0.0485075
Normalized OD Score: sc h 0.6398±0.0658387
Z-Score: -17.6424±2.10727
p-Value: 0
Z-Factor: 0.22179
Fitness Defect: INF
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:18|D9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.40 Celcius
Date:2008-04-23 YYYY-MM-DD
Plate CH Control (+):0.040675±0.00131
Plate DMSO Control (-):0.661±0.01714
Plate Z-Factor:0.9084
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DBLink | Rows returned: 2
3610 4-hexylbenzene-1,3-diol
75055 4-cyclohexylbenzene-1,3-diol

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 7311 | Additional Members: 1 | Rows returned: 0

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