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Compound InformationSONAR Target prediction
Name:

Clonidine hydrochloride

Unique Identifier:LOPAC 00086
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C9Cl3H10N3
Molecular Weight:256.475 g/mol
X log p:7.348  (online calculus)
Lipinksi Failures1
TPSA12.36
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:3
Rotatable Bond Count:1
Canonical Smiles:Cl.Clc1cccc(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 0.6251±0.0013435
Normalized OD Score: sc h 0.9969±0.0259442
Z-Score: -0.0459±0.773223
p-Value: 0.584944
Z-Factor: -5.82067
Fitness Defect: 0.5362
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:4|C9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:0.00 Celcius
Date:2005-04-20 YYYY-MM-DD
Plate CH Control (+):0.046825±0.00096
Plate DMSO Control (-):0.7020500000000001±0.15227
Plate Z-Factor:0.3359
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 2
LOPAC 00087 0.9322
SPE01500198 1.0000

active | Cluster 157 | Additional Members: 6 | Rows returned: 0
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