Bioactive Compound Details
| BioID | bio4161 |
|---|---|
| Name | IP-2018 |
| ChEMBL ID | CHEMBL4650310 |
| Molecular Formula | C16H17NO3 |
| Molecular Weight | 271.32 |
| Molecular Weight (Monoisotopic) | 271.1208 |
| Type | Small molecule |
| Max Phase | Phase 2 |
| Target ID | Tar21 |
| Target Name | Inflammation pathogenesis (IP) |
| Synonyms | IP-2018|IP2018 |
| Smiles | O=c1ccc2ccc(O[C@@H]3C[C@H]4CC[C@@H](C3)N4)cc2o1 |
| Inchi | InChI=1S/C16H17NO3/c18-16-6-2-10-1-5-13(9-15(10)20-16)19-14-7-11-3-4-12(8-14)17-11/h1-2,5-6,9,11-12,14,17H,3-4,7-8H2/t11-,12+,14- |
| Inchi Key | PGUDASZQLOAZRX-DABQJJPHSA-N |
| Molecular Species | BASE |
| Targets | None |
| Bioactivities | None |
| Np Likeness Score | 0.93 |
| Records Key | ['IP-2018'] |
| Records Name | ['IP-2018'] |
| Withdrawn Flag | False |
| Orphan | 0 |
Molecular Structure
