| BioID | bio199885 |
|---|
| Name | 7-METHYL-2-(3-NITROPHENYL)CHROMAN-4-ONE |
|---|
| ChEMBL ID | CHEMBL2252239 |
|---|
| Molecular Formula | C16H13NO4 |
|---|
| Molecular Weight | 283.28 |
|---|
| Molecular Weight (Monoisotopic) | 283.0845 |
|---|
| Type | Small molecule |
|---|
| Max Phase | -- |
|---|
| Target ID | Tar81 |
|---|
| Target Name | None |
|---|
| Synonyms | None |
|---|
| Smiles | Cc1ccc2c(c1)OC(c1cccc([N+](=O)[O-])c1)CC2=O |
|---|
| Inchi | InChI=1S/C16H13NO4/c1-10-5-6-13-14(18)9-15(21-16(13)7-10)11-3-2-4-12(8-11)17(19)20/h2-8,15H,9H2,1H3 |
|---|
| Inchi Key | OBTAQMIHVVJLBD-UHFFFAOYSA-N |
|---|
| Molecular Species | NEUTRAL |
|---|
| Targets | 1.0 |
|---|
| Bioactivities | 1.0 |
|---|
| Np Likeness Score | -0.01 |
|---|
| Records Key | ['33'] |
|---|
| Records Name | ['7-methyl-2-(3-nitrophenyl)chroman-4-one'] |
|---|
| Withdrawn Flag | False |
|---|
| Orphan | -1 |
|---|
