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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 91 92 93 94 95 96 97 98 99 100  Next >> [101]
Species: 4932
Condition: TOP1
Replicates: 2
Raw OD Value: r im 0.3929±0.000989949
Normalized OD Score: sc h 1.0775±0.00862192
Z-Score: 0.6721±0.0327921
p-Value: 0.501648
Z-Factor: -0.977212
Fitness Defect: 0.6899
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:13|G3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.80 Celcius
Date:2006-04-25 YYYY-MM-DD
Plate CH Control (+):0.039825±0.00139
Plate DMSO Control (-):0.372575±0.01569
Plate Z-Factor:0.8504
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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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