| Compound Information | SONAR Target prediction | | Name: | Adenosine 3`,5`-cyclic monophosphate | | Unique Identifier: | LOPAC 00694 | | MolClass: | Checkout models in ver1.5 and ver1.0 | | Molecular Formula: | C10H12N5O6P | | Molecular Weight: | 317.111 g/mol | | X log p: | 1.654 (online calculus) | | Lipinksi Failures | 1 | | TPSA | 94.89 | | Hydrogen Bond Donor Count: | 0 | | Hydrogen Bond Acceptors Count: | 11 | | Rotatable Bond Count: | 1 | | Canonical Smiles: | Nc1ncnc2n(cnc12)C1OC2COP(O)(=O)OC2C1O | | Class: | Phosphorylation | | Action: | Activator | | Selectivity: | PKA | | Generic_name: | CYCLIC AMP; CAMP | | Chemical_iupac_name: | ADENOSINE-3-,5--CYCLIC-MONOPHOSPHATE | | Drug_type: | Experimental | | Drugbank_id: | EXPT00959 | | Logp: | -0.53 +/- 0.57 | | Drug_category: | Adenylate Cyclase inhibitor | | Organisms_affected: | -1 |
| Species: |
4932 |
| Condition: |
SAP30 |
| Replicates: |
2 |
| Raw OD Value: r im |
0.8080±0.014425 |
| Normalized OD Score: sc h |
0.9894±0.00577578 |
| Z-Score: |
-0.9022±0.439724 |
| p-Value: |
0.389732 |
| Z-Factor: |
-4.24641 |
| Fitness Defect: |
0.9423 |
| Bioactivity Statement: |
Nonactive |
| Experimental Conditions | | | Library: | Lopac | | Plate Number and Position: | 2|A5 | | Drug Concentration: | 50.00 nM | | OD Absorbance: | 600 nm | | Robot Temperature: | 26.00 Celcius | | Date: | 2005-11-18 YYYY-MM-DD | | Plate CH Control (+): | 0.038725±0.00113 | | Plate DMSO Control (-): | 0.793075±0.01376 | | Plate Z-Factor: | 0.9513 |
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| 274 |
8-(6-aminopurin-9-yl)-3-hydroxy-3-oxo-2,4,7-trioxa-3$l^{5}-phosphabicyclo[4.3.0]nonan-9-ol |
| 6076 |
(1R,6R,8R,9R)-8-(6-aminopurin-9-yl)-3-hydroxy-3-oxo-2,4,7-trioxa-3$l^{5}-phosphabicyclo[4.3.0]nonan-9-ol |
| 94231 |
[(2R,3R,4R,5R)-5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-[(2R,3R,4R,5R)-5-(6-aminopurin-9-
yl)-4-hydroxy-2-(hydroxymethyl)oxolan-3-yl]oxy-phosphinic acid |
| 216877 |
sodium
(1R,6R,8R,9R)-8-(6-aminopurin-9-yl)-3-oxido-3-oxo-2,4,7-trioxa-3$l^{5}-phosphabicyclo[4.3.0]nonan-9-ol |
| 216878 |
(1R,6R,9R)-8-(6-aminopurin-9-yl)-3-hydroxy-3-oxo-2,4,7-trioxa-3$l^{5}-phosphabicyclo[4.3.0]nonan-9-ol |
| 260398 |
[5-(6-aminopurin-9-yl)-3,4-dihydroxy-oxolan-2-yl]methoxy-[5-(6-aminopurin-9-yl)-4-hydroxy-2-(hydroxymeth
yl)oxolan-3-yl]oxy-phosphinic acid |
| internal high similarity DBLink | Rows returned: 2 | |
| nonactive | Cluster 725 | Additional Members: 3 | Rows returned: 2 | |
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