Bioactive Compound Details
| BioID | bio8386 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL4743865 |
| Molecular Formula | C25H28N4O5 |
| Molecular Weight | 464.52 |
| Molecular Weight (Monoisotopic) | 464.206 |
| Type | Unknown |
| Max Phase | -- |
| Target ID | Tar31 |
| Target Name | IBD16 |
| Synonyms | None |
| Smiles | CCOc1cc2c(cc1OCC(N)=O)-c1c(c(Nc3cccc(C(=O)OC(C)C)c3)nn1C)C2 |
| Inchi | InChI=1S/C25H28N4O5/c1-5-32-20-11-16-10-19-23(18(16)12-21(20)33-13-22(26)30)29(4)28-24(19)27-17-8-6-7-15(9-17)25(31)34-14(2)3/h6-9,11-12,14H,5,10,13H2,1-4H3,(H2,26,30)(H,27,28) |
| Inchi Key | LCFCXJHZYALEDW-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 4.0 |
| Bioactivities | 4.0 |
| Np Likeness Score | -1.11 |
| Records Key | ['ID16'] |
| Records Name | ['Isopropyl 3-((7-(2-Amino-2-oxoethoxy)-6-ethoxy-1-methyl-1,4-dihydroindeno[1,2-c]pyrazol-3-yl)amino)benzoate'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
