Home | Screening data | Screen comparisons | Search for compounds | Structure search

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 1 2 3 4 5 6 7 8 9 10  Next >> [585]
Species: 4932
Condition: SPE00240740
Replicates: 2
Raw OD Value: r im 0.5734±0.0221324
Normalized OD Score: sc h 1.0033±0.0156638
Z-Score: 0.1625±0.684635
p-Value: 0.632818
Z-Factor: -17.613
Fitness Defect: 0.4576
Bioactivity Statement: Nonactive
Experimental Conditions
Library:SpectrumTMP
Plate Number and Position:1|G6
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:22.60 Celcius
Date:2006-11-29 YYYY-MM-DD
Plate CH Control (+):0.039275000000000004±0.00155
Plate DMSO Control (-):0.59585±0.02191
Plate Z-Factor:0.8530
png
ps
pdf

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

Service provided by the Mike Tyers Laboratory