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Compound InformationSONAR Target prediction
Name:

ARACHIDONIC ACID

Unique Identifier:SPE01504138
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:272.213 g/mol
X log p:15.756  (online calculus)
Lipinksi Failures2
TPSA17.07
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:2
Rotatable Bond Count:14
Canonical Smiles:CCCCCC=CCC=CCC=CCC=CCCCC(O)=O
Source:widespread in animal tissue
Therapeutics:prostaglandin & leucotriene precursor, stimulates NO biosynthesis
Generic_name:ARACHIDONIC ACID
Chemical_iupac_name:ARACHIDONIC ACID
Drug_type:Experimental
Kegg_compound_id:C00219
Drugbank_id:EXPT00409
Logp:4.881
Cas_registry_number:506-32-1
Drug_category:Prostaglandin H2 Synthase-1 inhibitor
Organisms_affected:-1

Found: 10 active | as graph: single | with analogs << Back 1 2 3 4 5 6 7 8 9 10 Next >> 
Species: 4932
Condition: YPT6
Replicates: 2
Raw OD Value: r im 0.4215±0.0145664
Normalized OD Score: sc h 0.8559±0.00472291
Z-Score: -4.0353±0.13799
p-Value: 0.0000590356
Z-Factor: 0.307253
Fitness Defect: 9.7374
Bioactivity Statement: Active
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:24|G5
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.10 Celcius
Date:2008-06-05 YYYY-MM-DD
Plate CH Control (+):0.041025000000000006±0.00284
Plate DMSO Control (-):0.48297500000000004±0.01395
Plate Z-Factor:0.8748
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DBLink | Rows returned: 21<< Back 1 2 3 4 Next >> 
5312409 (5E,8E)-tetradeca-5,8-dienoic acid
5312541 (5E,11E,14E,17E)-icosa-5,11,14,17-tetraenoic acid
5312542 (5E,8E,11E,14E)-icosa-5,8,11,14-tetraenoic acid
5312543 (5E,11E,14E,17E)-icosa-5,11,14,17-tetraenoic acid
5460265 (5E,8E,11E,14E)-icosa-5,8,11,14-tetraenoate
5462110 (5E,8E,11E,14E)-icosa-5,8,11,14-tetraenoic acid

internal high similarity DBLink | Rows returned: 1
LOPAC 00855 0.9783

active | Cluster 8909 | Additional Members: 3 | Rows returned: 0
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