Bioactive Compound Details
| BioID | bio59490 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL2260593 |
| Molecular Formula | C18H13NO4 |
| Molecular Weight | 307.31 |
| Molecular Weight (Monoisotopic) | 307.0845 |
| Type | Small molecule |
| Max Phase | -- |
| Target ID | Tar25 |
| Target Name | IBD12 |
| Synonyms | None |
| Smiles | COc1ccc(-c2onc3c2C(=O)c2ccccc2-3)cc1OC |
| Inchi | InChI=1S/C18H13NO4/c1-21-13-8-7-10(9-14(13)22-2)18-15-16(19-23-18)11-5-3-4-6-12(11)17(15)20/h3-9H,1-2H3 |
| Inchi Key | YFRQUQJOOJBHDV-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 6.0 |
| Bioactivities | 19.0 |
| Np Likeness Score | -0.09 |
| Records Key | ['BD12'] |
| Records Name | ['3-(3,4-dimethoxyphenyl)-4H-indeno[1,2-c][1,2]isoxazol-4-one'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
