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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 11 12 13 14 15 16 17 18 19 20  Next >> [104]
Species: 4932
Condition: CHS7
Replicates: 2
Raw OD Value: r im 0.5491±0.0118794
Normalized OD Score: sc h 0.9905±0.0134501
Z-Score: -0.3251±0.457387
p-Value: 0.757688
Z-Factor: -9.95935
Fitness Defect: 0.2775
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:1|A11
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.30 Celcius
Date:2008-02-21 YYYY-MM-DD
Plate CH Control (+):0.04065±0.00416
Plate DMSO Control (-):0.5448999999999999±0.01327
Plate Z-Factor:0.8742
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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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