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Compound InformationSONAR Target prediction
Name:

p-Aminoclonidine hydrochloride

Unique Identifier:LOPAC 00087
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C9Cl3H11N4
Molecular Weight:270.481 g/mol
X log p:4.682  (online calculus)
Lipinksi Failures0
TPSA12.36
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:4
Rotatable Bond Count:1
Canonical Smiles:Cl.Nc1cc(Cl)c(N=C2NCCN2)c(Cl)c1
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 0.6794±0.0295571
Normalized OD Score: sc h 1.0376±0.0266828
Z-Score: 1.1864±0.943583
p-Value: 0.333726
Z-Factor: -4.04484
Fitness Defect: 1.0974
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:1|D4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:0.00 Celcius
Date:2005-04-20 YYYY-MM-DD
Plate CH Control (+):0.05145±0.00553
Plate DMSO Control (-):0.6681999999999999±0.07984
Plate Z-Factor:0.5918
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 2
LOPAC 00086 0.9322
SPE01500198 0.9492

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