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Compound InformationSONAR Target prediction
Name:

PENFLURIDOL

Unique Identifier:SPE01505691
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C28ClF5H27NO
Molecular Weight:496.75 g/mol
X log p:  (online calculus)
Lipinksi Failures
TPSA
Hydrogen Bond Donor Count:
Hydrogen Bond Acceptors Count:
Rotatable Bond Count:
Canonical Smiles:OC1(CCN(CCCC(c2ccc(F)cc2)c2ccc(F)cc2)CC1)c1ccc(Cl)c(c1)C(F)(F)F
Source:synthetic; McN-JR-16341, R-16341
Therapeutics:antipsychotic

Found: 15 nonactive | as graph: single | with analogs << Back 1 2 3 4 5 6 7 8 9 10  Next >> 
Species: 4932
Condition: BY4743
Replicates: 2
Raw OD Value: r im 1.0020±0
Normalized OD Score: sc h 1.0067±0
Z-Score: 1.7951±0
p-Value: 0.0726374
Z-Factor: -6.8942
Fitness Defect: 2.6223
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum_ED
Plate Number and Position:13|C10
Drug Concentration:50.00 nM
OD Absorbance:595 nm
Robot Temperature:30.00 Celcius
Date:2012-05-28 YYYY-MM-DD
Plate CH Control (+):0.0915±0.01195
Plate DMSO Control (-):0.975±0.03404
Plate Z-Factor:0.8438
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DBLink | Rows returned: 0

internal high similarity DBLink | Rows returned: 0

active | Cluster 16161 | Additional Members: 10 | Rows returned: 4
SPE02300241 0.493506493506494
LOPAC 00317 0.279411764705882
LOPAC 00287 0
SPE01500325 0

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