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Compound InformationSONAR Target prediction
Name:

N-Acetyl-5-hydroxytryptamine

Unique Identifier:LOPAC 00650
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C12H14N2O2
Molecular Weight:204.141 g/mol
X log p:8.032  (online calculus)
Lipinksi Failures1
TPSA17.07
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:4
Canonical Smiles:CC(=O)NCCc1cnc2ccc(O)cc12
Class:Melatonin
Action:Precursor

Found: 24 nonactive as graph: single | with analogs [1] << Back 1 2 3 4 5 6 7 8 9 10  Next >> [24]
Species: 4932
Condition: CIN2
Replicates: 2
Raw OD Value: r im 0.8489±0.00289914
Normalized OD Score: sc h 1.0084±0.00301796
Z-Score: 0.6492±0.292705
p-Value: 0.525118
Z-Factor: -10.5523
Fitness Defect: 0.6441
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:1|E5
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.00 Celcius
Date:2005-12-07 YYYY-MM-DD
Plate CH Control (+):0.039175±0.00129
Plate DMSO Control (-):0.81145±0.01249
Plate Z-Factor:0.9410
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 3
SPE01500690 0.9043
AC 22693 1.0000
SPE01500700 1.0000

active | Cluster 10596 | Additional Members: 6 | Rows returned: 0
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