| BioID | bio198403 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL1972186 |
|---|
| Molecular Formula | C16H12O4 |
|---|
| Molecular Weight | 268.27 |
|---|
| Molecular Weight (Monoisotopic) | 268.0736 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 3-(2-Hydroxyphenacyl)Phthalide |
|---|
| Smiles | O=C(CC1OC(=O)c2ccccc21)c1ccccc1O |
|---|
| Inchi | InChI=1S/C16H12O4/c17-13-8-4-3-7-12(13)14(18)9-15-10-5-1-2-6-11(10)16(19)20-15/h1-8,15,17H,9H2 |
|---|
| Inchi Key | KKTFEYRHVJRQAF-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 56.0 |
|---|
| Bioactivities | 58.0 |
|---|
| Np Likeness Score | 0.3 |
|---|
| Records Key | ['4h', '2', 'SID490551'] |
|---|
| Records Name | ['3-(2-Hydroxyphenacyl)phthalide', '3-(2-(2-hydroxyphenyl)-2-oxoethyl)isobenzofuran-1(3H)-one', 'SID490551'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
