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Compound InformationSONAR Target prediction
Name:

Gentian Violet

Unique Identifier:LAT001C09
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C25ClH31N3
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

Found: 5 active as graph: single | with analogs << Back 1 2 3 4 5 Next >> 
Species: 4932
Condition: pdr22h
Replicates: 2
Raw OD Value: r im 0.4169±0.0355675
Normalized OD Score: sc h 0.6100±0.0545025
Z-Score: -15.4252±4.02794
p-Value: 1.41312e-36
Z-Factor: -3.2626
Fitness Defect: 82.5473
Bioactivity Statement: Active
Experimental Conditions
Library:LATCA
Plate Number and Position:1|C9
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.90 Celcius
Date:2007-03-08 YYYY-MM-DD
Plate CH Control (+):0.039875±0.00191
Plate DMSO Control (-):0.69555±0.23190
Plate Z-Factor:-0.0688
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 7585 | Additional Members: 2 | Rows returned: 1
SPE01500315 0

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