Compound Information | SONAR Target prediction | Name: | DEOXYADENOSINE | Unique Identifier: | SPE01502238 | MolClass: | Checkout models in ver1.5 and ver1.0 | Molecular Formula: | | Molecular Weight: | 238.139 g/mol | X log p: | 2.791 (online calculus) | Lipinksi Failures | 0 | TPSA | 49.55 | Hydrogen Bond Donor Count: | 0 | Hydrogen Bond Acceptors Count: | 8 | Rotatable Bond Count: | 2 | Canonical Smiles: | Nc1ncnc2n(cnc12)C1CC(O)C(CO)O1 | Class: | alkaloid | Source: | synthetic | Generic_name: | 2--DEOXYADENOSINE | Chemical_iupac_name: | 5-(6-AMINO-PURIN-9-YL)-2-HYDROXYMETHYL-TETRAHYDRO-FURAN-3-OL | Drug_type: | Experimental | Drugbank_id: | EXPT00166 | Logp: | -1.08 | Drug_category: | Purine Trans Deoxyribosylase inhibitor | Organisms_affected: | -1 |
Species: |
4932 |
Condition: |
pdr_yCG196 |
Replicates: |
2 |
Raw OD Value: r im |
0.6255±0.013435 |
Normalized OD Score: sc h |
0.8422±0.0247799 |
Z-Score: |
-5.2760±0.788702 |
p-Value: |
0.00000119179 |
Z-Factor: |
-0.124285 |
Fitness Defect: |
13.6401 |
Bioactivity Statement: |
Active |
Experimental Conditions | | Library: | Spectrum_ED | Plate Number and Position: | 19|B3 | Drug Concentration: | 50.00 nM | OD Absorbance: | 595 nm | Robot Temperature: | 30.00 Celcius | Date: | 2010-08-10 YYYY-MM-DD | Plate CH Control (+): | 0.09925±0.00547 | Plate DMSO Control (-): | 0.9100000000000001±0.02790 | Plate Z-Factor: | 0.8705 |
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636 |
5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol |
13730 |
(2R,3S,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol |
72246 |
(2R,3R,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol |
453553 |
(2S,3R,5R)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol |
489519 |
(2S,3R,5S)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol |
6541020 |
(2R,3R,5S)-5-(6-aminopurin-9-yl)-2-(hydroxymethyl)oxolan-3-ol |
internal high similarity DBLink | Rows returned: 4 | |
active | Cluster 9750 | Additional Members: 25 | Rows returned: 3 | |
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