| Compound Information | SONAR Target prediction |
| Name: | CREATININE |
| Unique Identifier: | SPE01600300 |
| MolClass: | Checkout models in ver1.5 and ver1.0 |
| Molecular Formula: | |
| Molecular Weight: | 106.062 g/mol |
| X log p: | -0.031 (online calculus) |
| Lipinksi Failures | 0 |
| TPSA | 20.31 |
| Hydrogen Bond Donor Count: | 0 |
| Hydrogen Bond Acceptors Count: | 4 |
| Rotatable Bond Count: | 0 |
| Canonical Smiles: | CN1CC(=O)NC1=N |
| Class: | alkaloid |
| Source: | metabolite in muscle and urine; renal metabolite |
| Reference: | J Biol Chem 81:73 (1929); JACS 93:5552 (1971) |
| Therapeutics: | metabolic enhancer |
| Found: 205 nonactive as graph: single | with analogs | [1] << Back 161 162 163 164 165 166 167 168 169 170 Next >> [205] |
| Species: | 4932 |
| Condition: | PFK2 |
| Replicates: | 2 |
| Raw OD Value: r im | 0.5015±0.0168999 |
| Normalized OD Score: sc h | 1.0795±0.000689723 |
| Z-Score: | 2.5513±0.00853763 |
| p-Value: | 0.0107347 |
| Z-Factor: | -0.859263 |
| Fitness Defect: | 4.5343 |
| Bioactivity Statement: | Nonactive |
| ps |
| DBLink | Rows returned: 0 |
| internal high similarity DBLink | Rows returned: 0 |
| active | Cluster 1453 | Additional Members: 1 | Rows returned: 0 |
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