Bioactive Compound Details
| BioID | bio199262 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL2047932 |
| Molecular Formula | C10H8ClNO |
| Molecular Weight | 193.63 |
| Molecular Weight (Monoisotopic) | 193.0294 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2-((4-Chlorophenyl)(Hydroxy)Methyl)Acrylonitrile |
| Smiles | C=C(C#N)C(O)c1ccc(Cl)cc1 |
| Inchi | InChI=1S/C10H8ClNO/c1-7(6-12)10(13)8-2-4-9(11)5-3-8/h2-5,10,13H,1H2 |
| Inchi Key | JYCZGEVNRFSAQJ-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 6.0 |
| Bioactivities | 6.0 |
| Np Likeness Score | -0.34 |
| Records Key | ['95'] |
| Records Name | ['2-((4-chlorophenyl)(hydroxy)methyl)acrylonitrile'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
