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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 11 12 13 14 15 16 17 18 19 20  Next >> [24]
Species: 4932
Condition: MRC1
Replicates: 2
Raw OD Value: r im 0.7993±0.00622254
Normalized OD Score: sc h 0.9948±0.00288721
Z-Score: -0.3697±0.174976
p-Value: 0.713734
Z-Factor: -7.57448
Fitness Defect: 0.3372
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:2|D2
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.30 Celcius
Date:2005-12-06 YYYY-MM-DD
Plate CH Control (+):0.039575±0.17082
Plate DMSO Control (-):0.7958000000000001±0.01041
Plate Z-Factor:0.9512
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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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