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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
Species: 4932
Condition: TOR1
Replicates: 2
Raw OD Value: r im 0.9310±0.0173241
Normalized OD Score: sc h 0.9314±0.0136823
Z-Score: -0.7713±0.492937
p-Value: 0.467602
Z-Factor: -1.14097
Fitness Defect: 0.7601
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 (+):0.000275±0.00325
Plate DMSO Control (-):1.0075500000000002±0.03017
Plate Z-Factor:0.8747
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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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