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Compound InformationSONAR Target prediction
Name:

Nocodazole

Unique Identifier:Prest359
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C14H11N3O3S
Molecular Weight:290.234 g/mol
X log p:12.165  (online calculus)
Lipinksi Failures1
TPSA81.03
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:6
Rotatable Bond Count:5
Canonical Smiles:COC(=O)Nc1nc2ccc(cc2n1)C(=O)c1sccc1

Found: 3 nonactive as graph: single | with analogs 1 2 3 Next >> 
Species: 9606
Condition: TMPPre001
Replicates: 2
Raw OD Value: r im 2107.0000±0
Normalized OD Score: sc h 1.0275±0
Z-Score: 0.6197±0
p-Value: 0.535436
Z-Factor: -5.74139
Fitness Defect: 0.6247
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Prestwick
Plate Number and Position:2|B11
Drug Concentration:50.00 nM
OD Absorbance:0 nm
Robot Temperature:23.40 Celcius
Date:2006-10-10 YYYY-MM-DD
Plate CH Control (+):979±955.64442
Plate DMSO Control (-):1983.5±536.09994
Plate Z-Factor:-4.7841
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 3124 | Additional Members: 12 | Rows returned: 81 2 Next >> 
000A-0229 0.492063492063492
Prest1169 0.483870967741936
Prest675 0.46031746031746
4569-1457 0.450704225352113
LOPAC 01029 0.370967741935484
LAT002F08 0

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