| Compound Information | SONAR Target prediction |
| Name: | 4-AMINO-3- (5-CHLOROTHIEN-2-YL)BUTANOIC ACID |
| Unique Identifier: | SPE01502143 |
| MolClass: | Checkout models in ver1.5 and ver1.0 |
| Molecular Formula: | C8ClH10NO2S |
| Molecular Weight: | 209.61 g/mol |
| X log p: | 3.82 (online calculus) |
| Lipinksi Failures | 0 |
| TPSA | 42.37 |
| Hydrogen Bond Donor Count: | 0 |
| Hydrogen Bond Acceptors Count: | 3 |
| Rotatable Bond Count: | 4 |
| Canonical Smiles: | NCC(CC(O)=O)c1sc(Cl)cc1 |
| Reference: | J Med Chem 34: 2557 (1991); Eur J Pharmacol 221: 145 (1992) |
| Therapeutics: | GABAb central agonist, GABAb gp illeum antagonist |
| Found: 101 nonactive as graph: single | with analogs | [1] << Back 1 2 3 4 5 6 7 8 9 10 Next >> [101] |
| Species: | 4932 |
| Condition: | BNI4 |
| Replicates: | 2 |
| Raw OD Value: r im | 0.7193±0.0241123 |
| Normalized OD Score: sc h | 0.9890±0.00554592 |
| Z-Score: | -0.3358±0.144974 |
| p-Value: | 0.738384 |
| Z-Factor: | -7.00403 |
| Fitness Defect: | 0.3033 |
| Bioactivity Statement: | Nonactive |
| ps |
| DBLink | Rows returned: 1 |
| 125917 | 4-amino-3-(5-chlorothiophen-2-yl)butanoic acid |
| internal high similarity DBLink | Rows returned: 0 |
| active | Cluster 10253 | Additional Members: 6 | Rows returned: 0 |
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