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Compound InformationSONAR Target prediction
Name:

Oleic Acid

Unique Identifier:LOPAC 01105
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C18H34O2
Molecular Weight:248.191 g/mol
X log p:3.318  (online calculus)
Lipinksi Failures1
TPSA17.07
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:2
Rotatable Bond Count:15
Canonical Smiles:CCCCCCCC=CCCCCCCCCC(O)=O
Class:Phosphorylation
Action:Activator
Selectivity:PKC
Generic_name:OLEIC ACID
Chemical_iupac_name:OLEIC ACID
Drug_type:Experimental
Kegg_compound_id:C00712
Drugbank_id:EXPT02430
Logp:6.036
Cas_registry_number:112-80-1
Drug_category:Serum Albumin inhibitor
Organisms_affected:-1

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: KRE1
Replicates: 2
Raw OD Value: r im 0.7069±0.024678
Normalized OD Score: sc h 1.0268±0.00987735
Z-Score: 1.1508±0.462974
p-Value: 0.27481
Z-Factor: -2.21252
Fitness Defect: 1.2917
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:12|B4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.90 Celcius
Date:2005-11-22 YYYY-MM-DD
Plate CH Control (+):0.038349999999999995±0.00146
Plate DMSO Control (-):0.6758500000000001±0.02039
Plate Z-Factor:0.9479
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DBLink | Rows returned: 2821 2 3 4 5 6 7 8 9 10  Next >> [47]
965 octadec-9-enoic acid
4668 hexadec-9-enoic acid
8216 docos-13-enoic acid
10416 7-(2-octyl-1-cyclopropenyl)heptanoic acid
11634 octadec-6-enoic acid
12921 8-(2-octyl-1-cyclopropenyl)octanoic acid

internal high similarity DBLink | Rows returned: 5
SPE00100550 0.9091
SPE01800031 0.9091
BTBG 00247 0.9524
SPE00310016 1.0000
SPE01500856 1.0000

nonactive | Cluster 13466 | Additional Members: 2 | Rows returned: 1
LOPAC 00855 0

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