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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 11 12 13 14 15 16 17 18 19 20  Next >> [24]
Species: 4932
Condition: NOP13
Replicates: 2
Raw OD Value: r im 0.8647±0.182575
Normalized OD Score: sc h 1.0074±0.00534463
Z-Score: 0.3698±0.303366
p-Value: 0.717798
Z-Factor: -4.37049
Fitness Defect: 0.3316
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:1|E5
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:0.00 Celcius
Date:2005-04-22 YYYY-MM-DD
Plate CH Control (+):0.0587±0.00658
Plate DMSO Control (-):0.73055±0.25803
Plate Z-Factor:-0.3563
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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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