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Compound InformationSONAR Target prediction
Name:

9-cyclopentyladenine

Unique Identifier:LOPAC 00771
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:C11H17N5O3S
Molecular Weight:282.216 g/mol
X log p:3.237  (online calculus)
Lipinksi Failures0
TPSA40.32
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:5
Rotatable Bond Count:1
Canonical Smiles:CS(O)(=O)=O.Nc1ncnc2n(cnc12)C1CCCC1
Class:Cyclic Nucleotides
Action:Inhibitor
Selectivity:Adenylate cyclase

Found: 24 nonactive as graph: single | with analogs [1] << Back 21 22 23 24 Next >> [24]
Species: 4932
Condition: WHI3
Replicates: 2
Raw OD Value: r im 0.7682±0.114622
Normalized OD Score: sc h 1.0067±0.0098932
Z-Score: 0.2107±0.317094
p-Value: 0.826418
Z-Factor: -6.07484
Fitness Defect: 0.1907
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:4|D4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:0.00 Celcius
Date:2005-04-20 YYYY-MM-DD
Plate CH Control (+):0.04475±0.00173
Plate DMSO Control (-):0.6949000000000001±0.05718
Plate Z-Factor:0.8314
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DBLink | Rows returned: 1
6604076 9-cyclopentylpurin-6-amine; methanesulfonic acid

internal high similarity DBLink | Rows returned: 0

nonactive | Cluster 9750 | Additional Members: 25 | Rows returned: 201 2 3 4 Next >> 
SPE01503416 0.508771929824561
LOPAC 01041 0.508771929824561
SPE01505705 0.477611940298508
SPE01505167 0.446428571428571
LOPAC 00464 0.436363636363636
Prest466 0.433333333333333

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