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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 1 2 3 4 5 6 7 8 9 10  Next >> [24]
Species: 4932
Condition: ESC2
Replicates: 2
Raw OD Value: r im 0.5458±0.0386787
Normalized OD Score: sc h 1.0115±0.0214689
Z-Score: 0.3789±0.690554
p-Value: 0.649356
Z-Factor: -6.77832
Fitness Defect: 0.4318
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:8|G9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:28.20 Celcius
Date:2005-11-25 YYYY-MM-DD
Plate CH Control (+):0.04005±0.00510
Plate DMSO Control (-):0.54505±0.01310
Plate Z-Factor:0.9130
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DBLink | Rows returned: 88<< Back 11 12 13 14 15 Next >> 
7162268 (1S,2R,5S,6R)-2-hydroxybicyclo[3.2.1]octane-6-carboxylate
7162269 (1S,2R,5S,6R)-2-hydroxybicyclo[3.2.1]octane-6-carboxylic acid
7173468 (4S)-4-[(3R,5S,7R,8R,9R,10S,13R,14R,17R)-3,7-dihydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,
16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate
7173469 (4S)-4-[(3R,5S,7R,8R,9R,10S,13R,14R,17R)-3,7-dihydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,
16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
7173470 (4S)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,
16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoate
7173471 (4S)-4-[(3R,5S,7R,8R,9S,10S,13R,14S,17R)-3,7-dihydroxy-10,13-dimethyl-12-oxo-1,2,3,4,5,6,7,8,9,11,14,15,
16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic 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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