Bioactive Compound Details
| BioID | bio35890 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL4473253 |
| Molecular Formula | C25H23N5O2 |
| Molecular Weight | 425.49 |
| Molecular Weight (Monoisotopic) | 425.1852 |
| Type | Unknown |
| Max Phase | -- |
| Target ID | Tar38 |
| Target Name | IBD8 |
| Synonyms | None |
| Smiles | COc1ccc(-c2ccc(Cn3cc(-c4ccc(NC(=O)C5CC5)cc4)nn3)cc2)cn1 |
| Inchi | InChI=1S/C25H23N5O2/c1-32-24-13-10-21(14-26-24)18-4-2-17(3-5-18)15-30-16-23(28-29-30)19-8-11-22(12-9-19)27-25(31)20-6-7-20/h2-5,8-14,16,20H,6-7,15H2,1H3,(H,27,31) |
| Inchi Key | SKSPKMMFLRTXTH-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 4.0 |
| Bioactivities | 4.0 |
| Np Likeness Score | -1.96 |
| Records Key | ['BD8'] |
| Records Name | ['N-(4-(1-(4-(6-methoxypyridin-3-yl)benzyl)-1H-1,2,3-triazol-4yl)phenyl)cyclopropanecar boxamide'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
