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Compound InformationSONAR Target prediction
Name:

CHLORHEXIDINE

Unique Identifier:SPE01500177
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:546.114 g/mol
X log p:15.712  (online calculus)
Lipinksi Failures2
TPSA0
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:10
Rotatable Bond Count:17
Canonical Smiles:Cl.Cl.Clc1ccc(NC(=N)NC(=N)NCCCCCCNC(=N)NC(=N)Nc2ccc(Cl)cc2)cc1
Source:synthetic
Therapeutics:antibacterial (topical), disinfectant

Found: 201 active | as graph: single | with analogs [1] << Back 161 162 163 164 165 166 167 168 169 170  Next >> [201]
Species: 4932
Condition: PPZ1
Replicates: 2
Raw OD Value: r im 0.0389±0.000141421
Normalized OD Score: sc h 0.0482±0.000423856
Z-Score: -48.1744±1.47436
p-Value: 0
Z-Factor: 0.954126
Fitness Defect: INF
Bioactivity Statement: Toxic
Experimental Conditions
Library:Spectrum
Plate Number and Position:18|B2
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.80 Celcius
Date:2006-05-17 YYYY-MM-DD
Plate CH Control (+):0.038±0.00213
Plate DMSO Control (-):0.7957500000000001±0.01124
Plate Z-Factor:0.9538
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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
SPE01503074 0.547169811320755
LAT002C07 0

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