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Compound InformationSONAR Target prediction
Name:

GENTIAN VIOLET

Unique Identifier:SPE01500315
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:377.74 g/mol
X log p:27.412  (online calculus)
Lipinksi Failures1
TPSA9.49
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:2
Rotatable Bond Count:4
Canonical Smiles:[ClH-].CN(C)c1ccc(cc1)C(c1ccc(cc1)N(C)C)=c1ccc(cc1)=[N+](C)C
Source:synthetic
Therapeutics:antibacterial, anthelmintic

Found: 199 active | as graph: single | with analogs [1] << Back 191 192 193 194 195 196 197 198 199 Next >> [199]
Species: 4932
Condition: YPT6
Replicates: 2
Raw OD Value: r im 0.2633±0.0432042
Normalized OD Score: sc h 0.6503±0.0708572
Z-Score: -9.7793±1.9674
p-Value: 2.4687e-17
Z-Factor: 0.0737812
Fitness Defect: 38.2403
Bioactivity Statement: Toxic
Experimental Conditions
Library:Spectrum
Plate Number and Position:12|C8
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.60 Celcius
Date:2006-02-22 YYYY-MM-DD
Plate CH Control (+):0.0419±0.00264
Plate DMSO Control (-):0.31925000000000003±0.02047
Plate Z-Factor:0.7093
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DBLink | Rows returned: 1
313 hydrogen chloride

internal high similarity DBLink | Rows returned: 0

active | Cluster 7585 | Additional Members: 2 | Rows returned: 1
LAT001C09 0

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