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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 61 62 63 64 65 66 67 68 69 70  Next >> [201]
Species: 4932
Condition: SEC66
Replicates: 2
Raw OD Value: r im 0.0432±0.000141421
Normalized OD Score: sc h 0.0764±0.000470707
Z-Score: -34.4254±1.17325
p-Value: 0
Z-Factor: 0.870277
Fitness Defect: INF
Bioactivity Statement: Toxic
Experimental Conditions
Library:SPECMTS3
Plate Number and Position:7|G10
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:24.00 Celcius
Date:2007-12-07 YYYY-MM-DD
Plate CH Control (+):0.044075±0.00043
Plate DMSO Control (-):0.54295±0.02134
Plate Z-Factor:0.8653
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 3172 | Additional Members: 6 | Rows returned: 3
Prest42 0.547169811320755
SPE01503074 0.547169811320755
Prest53 0

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