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Compound InformationSONAR Target prediction
Name:

5-hydroxydecanoic acid sodium

Unique Identifier:LOPAC 00965
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C10H19NaO3
Molecular Weight:191.095 g/mol
X log p:-1.325  (online calculus)
Lipinksi Failures0
TPSA40.13
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:8
Canonical Smiles:[Na+].[O-]C(=O)CCCC(O)CCCCC
Class:K+ Channel
Action:Blocker

Found: 24 nonactive as graph: single | with analogs [1] << Back 21 22 23 24 Next >> [24]
Species: 4932
Condition: tep1-2nd
Replicates: 2
Raw OD Value: r im 0.7970±0.0814587
Normalized OD Score: sc h 1.0439±0.0262738
Z-Score: 1.6720±1.01619
p-Value: 0.178579
Z-Factor: -2.6868
Fitness Defect: 1.7227
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:8|G9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:0.00 Celcius
Date:2005-07-07 YYYY-MM-DD
Plate CH Control (+):0.044274999999999995±0.00219
Plate DMSO Control (-):0.7455±0.03202
Plate Z-Factor:0.8997
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DBLink | Rows returned: 88<< Back 11 12 13 14 15 Next >> 
6925925 2-[(5S,7S)-3-hydroxy-1-adamantyl]acetic acid
6925926 2-[(5R,7R)-3-hydroxy-1-adamantyl]acetate
6928771 (1S,2S,5S,6R)-2-hydroxybicyclo[3.2.1]octane-6-carboxylate
6928772 (1S,2S,5S,6R)-2-hydroxybicyclo[3.2.1]octane-6-carboxylic acid
6954332 (3S,5S)-4-hydroxyadamantane-1-carboxylate
6954333 (3S,5S)-4-hydroxyadamantane-1-carboxylic acid

internal high similarity DBLink | Rows returned: 142 3 Next >> 
SPE01500840 0.9130
SPE01500837 0.9130
SPE01500605 0.9130
BTB 09776 0.9167
RH 01730 0.9167
SPE01504104 0.9167

active | Cluster 12601 | Additional Members: 1 | Rows returned: 0

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