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Compound InformationSONAR Target prediction
Name:

Prenylamine lactate

Unique Identifier:Prest878
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C28H35NO2
Molecular Weight:382.305 g/mol
X log p:31.65  (online calculus)
Lipinksi Failures1
TPSA0
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:1
Rotatable Bond Count:8
Canonical Smiles:CC(O)C(C)=O.CC(Cc1ccccc1)NCCC(c1ccccc1)c1ccccc1

Found: 3 nonactive as graph: single | with analogs 1 2 3 Next >> 
Species: 9606
Condition: TMPPre001
Replicates: 2
Raw OD Value: r im 2098.0000±0
Normalized OD Score: sc h 1.0116±0
Z-Score: 0.2605±0
p-Value: 0.794486
Z-Factor: -5.80997
Fitness Defect: 0.2301
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Prestwick
Plate Number and Position:7|H11
Drug Concentration:50.00 nM
OD Absorbance:0 nm
Robot Temperature:24.10 Celcius
Date:2006-10-10 YYYY-MM-DD
Plate CH Control (+):951.5±923.27222
Plate DMSO Control (-):2006±543.99595
Plate Z-Factor:-4.4324
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 3400 | Additional Members: 5 | Rows returned: 1
SPE01501026 0

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