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Compound InformationSONAR Target prediction
Name:

PASINIAZID

Unique Identifier:SPE01503381
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C13H14N4O4
Molecular Weight:276.164 g/mol
X log p:4.869  (online calculus)
Lipinksi Failures0
TPSA17.07
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:1
Canonical Smiles:NNC(=O)c1ccncc1.Nc1ccc(C(O)=O)c(O)c1
Therapeutics:antibacterial (tuberculostatic)

Found: 101 nonactive as graph: single | with analogs [1] << Back 41 42 43 44 45 46 47 48 49 50  Next >> [101]
Species: 4932
Condition: HXT1
Replicates: 2
Raw OD Value: r im 0.6899±0.00190919
Normalized OD Score: sc h 0.9765±0.0102692
Z-Score: -1.2431±0.565252
p-Value: 0.24972
Z-Factor: -4.52903
Fitness Defect: 1.3874
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:13|G3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.20 Celcius
Date:2007-11-27 YYYY-MM-DD
Plate CH Control (+):0.041125±0.00039
Plate DMSO Control (-):0.696575±0.01853
Plate Z-Factor:0.9182
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DBLink | Rows returned: 1
16367 4-amino-2-hydroxy-benzoic acid; pyridine-4-carbohydrazide

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 8873 | Additional Members: 5 | Rows returned: 3
SPE00305025 0.511111111111111
Prest1250 0.393939393939394
SPE01500116 0

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