| BioID | bio198037 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL2047938 |
|---|
| Molecular Formula | C10H7Cl2NO |
|---|
| Molecular Weight | 228.08 |
|---|
| Molecular Weight (Monoisotopic) | 226.9905 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 2-((2,4-Dichlorophenyl)(Hydroxy)Methyl)Acrylonitrile |
|---|
| Smiles | C=C(C#N)C(O)c1ccc(Cl)cc1Cl |
|---|
| Inchi | InChI=1S/C10H7Cl2NO/c1-6(5-13)10(14)8-3-2-7(11)4-9(8)12/h2-4,10,14H,1H2 |
|---|
| Inchi Key | AWOFTJQTKFDHCX-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 8.0 |
|---|
| Bioactivities | 8.0 |
|---|
| Np Likeness Score | -0.47 |
|---|
| Records Key | ['30', '101'] |
|---|
| Records Name | ['2-((2,4-Dichlorophenyl)(hydroxy)methyl)acrylonitrile', '2-((2,4-dichlorophenyl)(hydroxy)methyl)acrylonitrile'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
