Bioactive Compound Details
| BioID | bio50542 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL4574899 |
| Molecular Formula | C22H17F3N4 |
| Molecular Weight | 394.4 |
| Molecular Weight (Monoisotopic) | 394.1405 |
| Type | Unknown |
| Max Phase | -- |
| Target ID | Tar24 |
| Target Name | IBD9 |
| Synonyms | None |
| Smiles | FC(F)(F)c1ccc2nc(-c3cccc(N4CCc5ccccc5C4)n3)[nH]c2c1 |
| Inchi | InChI=1S/C22H17F3N4/c23-22(24,25)16-8-9-17-19(12-16)28-21(27-17)18-6-3-7-20(26-18)29-11-10-14-4-1-2-5-15(14)13-29/h1-9,12H,10-11,13H2,(H,27,28) |
| Inchi Key | XFXNOPJDCWHCHB-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 5.0 |
| Bioactivities | 6.0 |
| Np Likeness Score | -1.46 |
| Records Key | ['BD9'] |
| Records Name | ['2-(6-(6-(trifluoromethyl)-1H-benzo[d]imidazol-2-yl)pyridin-2-yl)-1,2,3,4-tetrahydroisoquinoline'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
