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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 11 12 13 14 15 Next >> 
Species: 4932
Condition: NPR1
Replicates: 2
Raw OD Value: r im 0.9025±0.0187383
Normalized OD Score: sc h 0.9355±0.0247037
Z-Score: -0.6857±1.09212
p-Value: 0.53795
Z-Factor: -1.96534
Fitness Defect: 0.62
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:2012-09-18 YYYY-MM-DD
Plate CH Control (+):0.0032500000000000003±0.00512
Plate DMSO Control (-):1.009175±0.03035
Plate Z-Factor:0.8913
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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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