Bioactive Compound Details
| BioID | bio4166 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL5190361 |
| Molecular Formula | C23H24N4O8S |
| Molecular Weight | 516.53 |
| Molecular Weight (Monoisotopic) | 516.1315 |
| Type | None |
| Max Phase | -- |
| Target ID | Tar37 |
| Target Name | IBD4 |
| Synonyms | None |
| Smiles | Nc1ccc(S(=O)(=O)N2CCN(C(=O)c3cc(O)c(O)c(O)c3)CC2C(=O)NCc2ccco2)cc1 |
| Inchi | InChI=1S/C23H24N4O8S/c24-15-3-5-17(6-4-15)36(33,34)27-8-7-26(23(32)14-10-19(28)21(30)20(29)11-14)13-18(27)22(31)25-12-16-2-1-9-35-16/h1-6,9-11,18,28-30H,7-8,12-13,24H2,(H,25,31) |
| Inchi Key | BLZDLGBTSQPDPX-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 4.0 |
| Bioactivities | 4.0 |
| Np Likeness Score | -1.27 |
| Records Key | ['IB-4'] |
| Records Name | ['1-((4-aminophenyl)sulfonyl)-N-(furan-2-ylmethyl)-4-(3,4,5-trihydroxybenzoyl)piperazine-2-carboxamide'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
