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Compound InformationSONAR Target prediction
Name:

ALEXIDINE HYDROCHLORIDE

Unique Identifier:SPE01503074
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:523.251 g/mol
X log p:-2.144  (online calculus)
Lipinksi Failures1
TPSA0
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:10
Rotatable Bond Count:27
Canonical Smiles:Cl.Cl.CCCCC(CC)CNC(=N)NC(=N)NCCCCCCNC(=N)NC(=N)NCC(CC)CCCC
Source:synthetic
Therapeutics:antibacterial

Found: 204 active | as graph: single | with analogs 1 2 3 4 5 6 7 8 9 10  Next >> [204]
Species: 4932
Condition: AAT2
Replicates: 2
Raw OD Value: r im 0.0407±0.000212132
Normalized OD Score: sc h 0.0557±0.000365285
Z-Score: -50.1583±1.12259
p-Value: 0
Z-Factor: 0.928465
Fitness Defect: INF
Bioactivity Statement: Toxic
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:11|B8
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.60 Celcius
Date:2008-04-08 YYYY-MM-DD
Plate CH Control (+):0.0403±0.00095
Plate DMSO Control (-):0.7031749999999999±0.01558
Plate Z-Factor:0.9242
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 3172 | Additional Members: 6 | Rows returned: 3
Prest42 0.547169811320755
SPE01500177 0
LAT002C07 0

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