Bioactive Compound Details
| BioID | bio4164 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL4794373 |
| Molecular Formula | C26H31N3O5 |
| Molecular Weight | 465.55 |
| Molecular Weight (Monoisotopic) | 465.2264 |
| Type | Unknown |
| Max Phase | -- |
| Target ID | Tar35 |
| Target Name | IBD26 |
| Synonyms | None |
| Smiles | CCOc1cc2c(cc1OCCCO)-c1c(c(Nc3cccc(C(=O)OC(C)C)c3)nn1C)C2 |
| Inchi | InChI=1S/C26H31N3O5/c1-5-32-22-14-18-13-21-24(20(18)15-23(22)33-11-7-10-30)29(4)28-25(21)27-19-9-6-8-17(12-19)26(31)34-16(2)3/h6,8-9,12,14-16,30H,5,7,10-11,13H2,1-4H3,(H,27,28) |
| Inchi Key | HLPUZJRSVFDTLG-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 4.0 |
| Bioactivities | 4.0 |
| Np Likeness Score | -0.7 |
| Records Key | ['ID26'] |
| Records Name | ['Isopropyl 3-((6-Ethoxy-7-(3-hydroxypropoxy)-1-methyl-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)amino)benzoate'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
