Bioactive Compound Details
| BioID | bio199032 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL497930 |
| Molecular Formula | C13H10N2 |
| Molecular Weight | 194.24 |
| Molecular Weight (Monoisotopic) | 194.0844 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar81 |
| Target Name | None |
| Synonyms | 2-(P-Tolylethynyl)Pyrimidine |
| Smiles | Cc1ccc(C#Cc2ncccn2)cc1 |
| Inchi | InChI=1S/C13H10N2/c1-11-3-5-12(6-4-11)7-8-13-14-9-2-10-15-13/h2-6,9-10H,1H3 |
| Inchi Key | WRORRSAZXXGHSQ-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 1.0 |
| Bioactivities | 2.0 |
| Np Likeness Score | -1.1 |
| Records Key | ['17c'] |
| Records Name | ['2-(p-tolylethynyl)pyrimidine'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
