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Compound InformationSONAR Target prediction
Name:

Fenbendazole

Unique Identifier:Prest213
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C15H13N3O2S
Molecular Weight:286.246 g/mol
X log p:16.734  (online calculus)
Lipinksi Failures1
TPSA63.96
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:5
Rotatable Bond Count:5
Canonical Smiles:COC(=O)Nc1nc2ccc(Sc3ccccc3)cc2n1

Found: 3 nonactive as graph: single | with analogs 1 2 3 Next >> 
Species: 9606
Condition: TMPPre001
Replicates: 2
Raw OD Value: r im 2256.0000±0
Normalized OD Score: sc h 1.0845±0
Z-Score: 1.9046±0
p-Value: 0.0568324
Z-Factor: -3.68329
Fitness Defect: 2.8676
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Prestwick
Plate Number and Position:3|E11
Drug Concentration:50.00 nM
OD Absorbance:0 nm
Robot Temperature:23.60 Celcius
Date:2006-10-10 YYYY-MM-DD
Plate CH Control (+):1037.5±978.23463
Plate DMSO Control (-):2014±552.18250
Plate Z-Factor:-4.9321
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 6488 | Additional Members: 5 | Rows returned: 3
SPE01503373 0.474576271186441
SPE01503903 0.385964912280702
SPE01501016 0

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