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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 11 12 13 14 15 16 17 18 19 20  Next >> [24]
Species: 4932
Condition: SAP30
Replicates: 2
Raw OD Value: r im 0.8223±0.00770746
Normalized OD Score: sc h 1.0085±0.00464415
Z-Score: 0.7220±0.353789
p-Value: 0.484014
Z-Factor: -3.90098
Fitness Defect: 0.7256
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:4|D4
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:26.10 Celcius
Date:2005-11-18 YYYY-MM-DD
Plate CH Control (+):0.040249999999999994±0.00179
Plate DMSO Control (-):0.7864±0.03817
Plate Z-Factor:0.6935
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DBLink | Rows returned: 1
6604076 9-cyclopentylpurin-6-amine; methanesulfonic acid

internal high similarity DBLink | Rows returned: 0

active | Cluster 9750 | Additional Members: 25 | Rows returned: 4
Prest466 0.433333333333333
SPE01502238 0.423728813559322
SPE01500667 0.258620689655172
Prest983 0

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