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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 111 112 113 114 115 116 117 118 119 120  Next >> [199]
Species: 4932
Condition: BRE1
Replicates: 2
Raw OD Value: r im 0.2770±0.0123037
Normalized OD Score: sc h 0.4919±0.0666636
Z-Score: -9.2275±1.63153
p-Value: 3.40516e-16
Z-Factor: 0.0942459
Fitness Defect: 35.6161
Bioactivity Statement: Active
Experimental Conditions
Library:Spectrum
Plate Number and Position:12|C8
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.30 Celcius
Date:2006-03-16 YYYY-MM-DD
Plate CH Control (+):0.03985±0.00172
Plate DMSO Control (-):0.561425±0.04585
Plate Z-Factor:0.8560
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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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