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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 81 82 83 84 85 86 87 88 89 90  Next >> [101]
Species: 4932
Condition: SWE1
Replicates: 2
Raw OD Value: r im 0.8010±0.0098995
Normalized OD Score: sc h 1.0093±0.00441962
Z-Score: 0.2860±0.155637
p-Value: 0.776208
Z-Factor: -5.10886
Fitness Defect: 0.2533
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:13|G3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.60 Celcius
Date:2006-04-19 YYYY-MM-DD
Plate CH Control (+):0.037875±0.00173
Plate DMSO Control (-):0.7706±0.02922
Plate Z-Factor:0.9142
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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

active | Cluster 8873 | Additional Members: 5 | Rows returned: 1
SPE00305025 0.511111111111111

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