| BioID | bio197523 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL226978 |
|---|
| Molecular Formula | C10H8BrNO |
|---|
| Molecular Weight | 238.08 |
|---|
| Molecular Weight (Monoisotopic) | 236.9789 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 2-((4-Bromophenyl)(Hydroxy)Methyl)Acrylonitrile|2-[Hydroxy(4-Bromophenyl)Methyl]Acrylonitrile |
|---|
| Smiles | C=C(C#N)C(O)c1ccc(Br)cc1 |
|---|
| Inchi | InChI=1S/C10H8BrNO/c1-7(6-12)10(13)8-2-4-9(11)5-3-8/h2-5,10,13H,1H2 |
|---|
| Inchi Key | IURFBZHUSDCBBV-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 5.0 |
|---|
| Bioactivities | 7.0 |
|---|
| Np Likeness Score | -0.13 |
|---|
| Records Key | ['4', '13'] |
|---|
| Records Name | ['2-[Hydroxy(4-bromophenyl)methyl]acrylonitrile', '2-((4-bromophenyl)(hydroxy)methyl)acrylonitrile'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
