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Compound InformationSONAR Target prediction
Name:

DIPHENYLUREA

Unique Identifier:SPE00211126
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:200.152 g/mol
X log p:20.438  (online calculus)
Lipinksi Failures1
TPSA17.07
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:4
Canonical Smiles:O=C(Nc1ccccc1)Nc1ccccc1
Class:aromatic
Source:coconut milk

Found: 6 active | as graph: single | with analogs 2 3 4 5 6 Next >> 
Species: 4932
Condition: BRE1
Replicates: 2
Raw OD Value: r im 0.5003±0.0588313
Normalized OD Score: sc h 1.2815±0.0381402
Z-Score: 5.0810±0.455327
p-Value: 0.00000100517
Z-Factor: 0.153914
Fitness Defect: 13.8104
Bioactivity Statement: Active
Experimental Conditions
Library:Spectrum
Plate Number and Position:4|E2
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:23.90 Celcius
Date:2006-03-16 YYYY-MM-DD
Plate CH Control (+):0.0398±0.00090
Plate DMSO Control (-):0.5064±0.02426
Plate Z-Factor:0.8660
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DBLink | Rows returned: 1
7595 1,3-diphenylurea

internal high similarity DBLink | Rows returned: 1
HTS 10991 0.9189

nonactive | Cluster 12793 | Additional Members: 20 | Rows returned: 2
KM 03072 0.509433962264151
SPE01501173 0.333333333333333

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