Bioactive Compound Details
| BioID | bio199215 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL2178736 |
| Molecular Formula | C8H8N2S |
| Molecular Weight | 164.23 |
| Molecular Weight (Monoisotopic) | 164.0408 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2-(2-Pyridyl)Ethyl Isothiocyanate |
| Smiles | S=C=NCCc1ccccn1 |
| Inchi | InChI=1S/C8H8N2S/c11-7-9-6-4-8-3-1-2-5-10-8/h1-3,5H,4,6H2 |
| Inchi Key | IVLUFOQCPWIXMW-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 8.0 |
| Bioactivities | 51.0 |
| Np Likeness Score | -1.01 |
| Records Key | ['PY-ITC'] |
| Records Name | ['2-(2-pyridyl)ethyl isothiocyanate'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
