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Compound InformationSONAR Target prediction
Name:

p-Iodoclonidine hydrochloride

Unique Identifier:LOPAC 00122
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C9Cl3H9IN3
Molecular Weight:383.379 g/mol
X log p:6.434  (online calculus)
Lipinksi Failures1
TPSA12.36
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:1
Canonical Smiles:Cl.Clc1cc(I)cc(Cl)c1N=C1NCCN1
Class:Adrenoceptor
Action:Agonist
Selectivity:alpha2

Found: 24 nonactive as graph: single | with analogs [1] << Back 21 22 23 24
Species: 4932
Condition: WHI5
Replicates: 2
Raw OD Value: r im 0.6924±0.0720542
Normalized OD Score: sc h 1.0649±0.0899503
Z-Score: 1.7987±2.48364
p-Value: 0.483234
Z-Factor: -4.28012
Fitness Defect: 0.7273
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:9|C5
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:0.00 Celcius
Date:2005-04-20 YYYY-MM-DD
Plate CH Control (+):0.046225±0.00775
Plate DMSO Control (-):0.6777±0.06033
Plate Z-Factor:0.6382
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 157 | Additional Members: 6 | Rows returned: 4
LOPAC 00734 0.538461538461538
LOPAC 00087 0.463414634146341
SPE01500198 0
LOPAC 00086 0

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