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Compound InformationSONAR Target prediction
Name:

BENZTROPINE

Unique Identifier:SPE01500142
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:
Molecular Weight:378.294 g/mol
X log p:20.956  (online calculus)
Lipinksi Failures1
TPSA12.47
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:2
Rotatable Bond Count:4
Canonical Smiles:CN1C2CCC1CC(C2)OC(c1ccccc1)c1ccccc1.OS(O)(=O)=O
Source:synthetic
Therapeutics:anticholinergic

Found: 585 nonactive | as graph: single | with analogs [1] << Back 571 572 573 574 575 576 577 578 579 580  Next >> [585]
Species: 4932
Condition: TUB3
Replicates: 2
Raw OD Value: r im 0.6798±0.0116673
Normalized OD Score: sc h 0.9934±0.0192808
Z-Score: -0.4068±1.15742
p-Value: 0.45056
Z-Factor: -24.3905
Fitness Defect: 0.7973
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Spectrum
Plate Number and Position:10|G3
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:25.90 Celcius
Date:2007-10-12 YYYY-MM-DD
Plate CH Control (+):0.040249999999999994±0.00141
Plate DMSO Control (-):0.677275±0.12110
Plate Z-Factor:0.4063
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DBLink | Rows returned: 1
5702011 3-benzhydryloxy-8-methyl-8-azabicyclo[3.2.1]octane; sulfuric acid

internal high similarity DBLink | Rows returned: 1
LOPAC 00174 0.9583

active | Cluster 2609 | Additional Members: 7 | Rows returned: 1
LOPAC 00255 0.170212765957447

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