| BioID | bio199572 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL122058 |
|---|
| Molecular Formula | C17H12O2 |
|---|
| Molecular Weight | 248.28 |
|---|
| Molecular Weight (Monoisotopic) | 248.0837 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | 2-Benzyl-[1,4]Naphthoquinone |
|---|
| Smiles | O=C1C=C(Cc2ccccc2)C(=O)c2ccccc21 |
|---|
| Inchi | InChI=1S/C17H12O2/c18-16-11-13(10-12-6-2-1-3-7-12)17(19)15-9-5-4-8-14(15)16/h1-9,11H,10H2 |
|---|
| Inchi Key | NRKPHAPQMRHQNY-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 4.0 |
|---|
| Bioactivities | 4.0 |
|---|
| Np Likeness Score | 0.93 |
|---|
| Records Key | ['11c', '26'] |
|---|
| Records Name | ['2-benzylnaphthalene-1,4-dione', '2-Benzyl-[1,4]naphthoquinone'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
