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Compound InformationSONAR Target prediction
Name:

Piroxicam

Unique Identifier:LOPAC 01144
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C15H13N3O4S
Molecular Weight:318.244 g/mol
X log p:16.369  (online calculus)
Lipinksi Failures1
TPSA75.19
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:7
Rotatable Bond Count:3
Canonical Smiles:CN1C(C(=O)Nc2ccccn2)=C(O)c2ccccc2S1(=O)=O
Class:Prostaglandin
Action:Inhibitor
Selectivity:COX

Found: 24 nonactive as graph: single | with analogs [1] << Back 11 12 13 14 15 16 17 18 19 20  Next >> [24]
Species: 4932
Condition: PAC10
Replicates: 2
Raw OD Value: r im 0.7166±0.00113137
Normalized OD Score: sc h 0.9838±0.00570025
Z-Score: -0.7400±0.268595
p-Value: 0.467366
Z-Factor: -341.426
Fitness Defect: 0.7606
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:12|B11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.60 Celcius
Date:2005-04-15 YYYY-MM-DD
Plate CH Control (+):0.045075000000000004±0.00073
Plate DMSO Control (-):0.7179500000000001±0.03738
Plate Z-Factor:0.9379
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 1
SPE01500491 1.0000

nonactive | Cluster 16469 | Additional Members: 9 | Rows returned: 81 2 Next >> 
SPE01503142 0.4
Prest849 0.4
SPE01504150 0.353846153846154
Prest505 0.295081967213115
SPE01503242 0.295081967213115
Prest573 0

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