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Compound InformationSONAR Target prediction
Name:

L-N6-(1-Iminoethyl)lysine hydrochloride

Unique Identifier:LOPAC 01348
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C8ClH18N3O2
Molecular Weight:205.557 g/mol
X log p:-2.017  (online calculus)
Lipinksi Failures0
TPSA17.07
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:5
Rotatable Bond Count:7
Canonical Smiles:Cl.CC(=N)NCCCCC(N)C(O)=O
Class:Nitric Oxide
Action:Inhibitor
Selectivity:iNOS

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: SQS1
Replicates: 2
Raw OD Value: r im 0.7493±0.0287085
Normalized OD Score: sc h 1.0126±0.000856457
Z-Score: 0.6279±0.0999336
p-Value: 0.531102
Z-Factor: -4.3112
Fitness Defect: 0.6328
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:9|C4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:0.00 Celcius
Date:2005-05-21 YYYY-MM-DD
Plate CH Control (+):0.048075±0.00238
Plate DMSO Control (-):0.7255499999999999±0.02484
Plate Z-Factor:0.8704
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 4071 | Additional Members: 12 | Rows returned: 91 2 Next >> 
LOPAC 00681 0.5
LOPAC 00411 0.333333333333333
SPE01502194 0.333333333333333
LOPAC 00447 0.333333333333333
LOPAC 00422 0.333333333333333
SPE01500855 0.314285714285714

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