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Compound InformationSONAR Target prediction
Name:

SECNIDAZOLE

Unique Identifier:SPE01505304
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C7H11N3O3
Molecular Weight:174.093 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:[O-][N+](=O)c1cnc(C)n1CC(C)O
Source:synthetic; PM-185184, RP-14539
Reference:Drugs 51:621 (1996)
Therapeutics:antiameobic, antitrichomonas

Found: 104 nonactive as graph: single | with analogs [1] << Back 71 72 73 74 75 76 77 78 79 80  Next >> [104]
Species: 4932
Condition: SUR2
Replicates: 2
Raw OD Value: r im 0.7238±0.0072832
Normalized OD Score: sc h 0.9820±0.00726857
Z-Score: -0.9089±0.347797
p-Value: 0.377748
Z-Factor: -5.06127
Fitness Defect: 0.9735
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:1|A11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:22.50 Celcius
Date:2008-05-06 YYYY-MM-DD
Plate CH Control (+):0.041075±0.00099
Plate DMSO Control (-):0.718575±0.01691
Plate Z-Factor:0.9178
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 6826 | Additional Members: 11 | Rows returned: 5
Prest584 0.479166666666667
SPE01502127 0.391304347826087
Prest136 0.391304347826087
SPE01500412 0
Prest334 0

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