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Compound InformationSONAR Target prediction
Name:

Amiloride hydrochloride

Unique Identifier:LOPAC 00165
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C6Cl2H9N7O
Molecular Weight:257.016 g/mol
X log p:-2.85  (online calculus)
Lipinksi Failures0
TPSA41.79
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:8
Rotatable Bond Count:3
Canonical Smiles:Cl.NC(=N)NC(=O)c1nc(Cl)c(N)nc1N
Class:Na+ Channel
Action:Blocker
Selectivity:Epithelial

Found: 24 nonactive as graph: single | with analogs [1] << Back 1 2 3 4 5 6 7 8 9 10  Next >> [24]
Species: 4932
Condition: GAS1
Replicates: 2
Raw OD Value: r im 0.6818±0.000848528
Normalized OD Score: sc h 0.9920±0.000153701
Z-Score: -0.3816±0.00711228
p-Value: 0.702766
Z-Factor: -2182.83
Fitness Defect: 0.3527
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:2|D2
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:27.40 Celcius
Date:2005-11-17 YYYY-MM-DD
Plate CH Control (+):0.0403±0.00211
Plate DMSO Control (-):0.6949750000000001±0.04216
Plate Z-Factor:0.6832
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 2
SPE01503999 0.9016
SPE01500112 1.0000

active | Cluster 4060 | Additional Members: 8 | Rows returned: 2
SPE01504215 0.462962962962963
SPE01500112 0

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