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Compound InformationSONAR Target prediction
Name:

JL-18

Unique Identifier:LOPAC 00288
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C18H21N5
Molecular Weight:286.226 g/mol
X log p:12.806  (online calculus)
Lipinksi Failures1
TPSA31.2
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:5
Rotatable Bond Count:1
Canonical Smiles:CN1CCN(CC1)C1=Nc2cccnc2Nc2ccc(C)cc21
Class:Dopamine
Action:Antagonist
Selectivity:D4>D2

Found: 24 nonactive as graph: single | with analogs 1 2 3 4 5 6 7 8 9 10  Next >> [24]
Species: 4932
Condition: BY4741
Replicates: 8
Raw OD Value: r im 0.7736±0.0611627
Normalized OD Score: sc h 0.9965±0.0314599
Z-Score: -0.1323±0.957675
p-Value: 0.569324
Z-Factor: -674.562
Fitness Defect: 0.5633
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:9|A7
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.70 Celcius
Date:2005-04-07 YYYY-MM-DD
Plate CH Control (+):0.04704375000000001±0.00145
Plate DMSO Control (-):0.7456624999999997±0.03931
Plate Z-Factor:0.8748
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DBLink | Rows returned: 1
3802

internal high similarity DBLink | Rows returned: 0

active | Cluster 6723 | Additional Members: 4 | Rows returned: 1
SPE01500685 0

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