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Compound InformationSONAR Target prediction
Name:

8-Bromo-cAMP sodium

Unique Identifier:LOPAC 00415
MolClass: Checkout models in ver1.5 and ver1.0
Molecular Formula:BrC10H10N5NaO6P
Molecular Weight:420.005 g/mol
X log p:0.39  (online calculus)
Lipinksi Failures1
TPSA117.95
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptors Count:11
Rotatable Bond Count:1
Canonical Smiles:[Na+].[O-]P1(=O)OCC2OC(C(O)C2O1)n1c(Br)nc2c(N)ncnc12
Class:Cyclic Nucleotides
Action:Activator

Found: 24 nonactive as graph: single | with analogs [1] << Back 1 2 3 4 5 6 7 8 9 10  Next >> [24]
Species: 4932
Condition: BY4743
Replicates: 2
Raw OD Value: r im 0.8635±0.190636
Normalized OD Score: sc h 0.9680±0.0145556
Z-Score: -0.8682±0.359173
p-Value: 0.40043
Z-Factor: -5.71803
Fitness Defect: 0.9152
Bioactivity Statement: Nonactive
Experimental Conditions
Library:Lopac
Plate Number and Position:3|C5
Drug Concentration:50.00 nM
OD Absorbance:600 nm
Robot Temperature:0.00 Celcius
Date:2005-08-19 YYYY-MM-DD
Plate CH Control (+):0.048125±0.00149
Plate DMSO Control (-):0.8186500000000001±0.02904
Plate Z-Factor:0.8953
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DBLink | Rows returned: 9<< Back 1 2
6604826 (1R,6S,8S,9S)-8-(6-amino-8-bromo-purin-9-yl)-3-hydroxy-3-oxo-2,4,7-trioxa-3$l^{5}-phosphabicyclo[4.3.0]n
onan-9-ol
6610262 (1S,6S,8S,9S)-8-(6-amino-8-bromo-purin-9-yl)-3-hydroxy-3-oxo-2,4,7-trioxa-3$l^{5}-phosphabicyclo[4.3.0]n
onan-9-ol
6610315 (1S,6S,9S)-8-(6-amino-8-bromo-purin-9-yl)-3-hydroxy-3-oxo-2,4,7-trioxa-3$l^{5}-phosphabicyclo[4.3.0]nona
n-9-ol

internal high similarity DBLink | Rows returned: 1
LOPAC 00694 0.9038

active | Cluster 1044 | Additional Members: 3 | Rows returned: 0

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