Bioactive Compound Details
| BioID | bio50544 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL4447552 |
| Molecular Formula | C20H15ClN4 |
| Molecular Weight | 346.82 |
| Molecular Weight (Monoisotopic) | 346.0985 |
| Type | Unknown |
| Max Phase | -- |
| Target ID | Tar24 |
| Target Name | IBD9 |
| Synonyms | None |
| Smiles | Clc1cccc(-c2cn(Cc3ccc(-c4cccnc4)cc3)nn2)c1 |
| Inchi | InChI=1S/C20H15ClN4/c21-19-5-1-3-17(11-19)20-14-25(24-23-20)13-15-6-8-16(9-7-15)18-4-2-10-22-12-18/h1-12,14H,13H2 |
| Inchi Key | DTIBDUZHSDASKY-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 4.0 |
| Bioactivities | 4.0 |
| Np Likeness Score | -1.85 |
| Records Key | ['BD9'] |
| Records Name | ['3-(4-((4-(3-chlorophenyl)-1H-1,2,3-triazol-1-yl)methyl)phenyl)pyridine'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
