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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 251 252 253 254 255 256 257 258 259 260  Next >> [585]
Species: 4932
Condition: SPE01502108
Replicates: 2
Raw OD Value: r im 0.4625±0.0633568
Normalized OD Score: sc h 0.9810±0.0391687
Z-Score: -0.3646±0.766084
p-Value: 0.6121
Z-Factor: -8.67796
Fitness Defect: 0.4909
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SpectrumTMP
Plate Number and Position:1|G6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:0.00 Celcius
Date:2007-01-17 YYYY-MM-DD
Plate CH Control (+):0.238225±0.00741
Plate DMSO Control (-):0.52945±1.72615
Plate Z-Factor:0.7776
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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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