Bioactive Compound Details
| BioID | bio17908 |
|---|---|
| Name | None |
| ChEMBL ID | CHEMBL4465753 |
| Molecular Formula | C22H20N4O |
| Molecular Weight | 356.43 |
| Molecular Weight (Monoisotopic) | 356.1637 |
| Type | Unknown |
| Max Phase | -- |
| Target ID | Tar29 |
| Target Name | IBD3 |
| Synonyms | None |
| Smiles | COc1ccc2nc(-c3cccc(N4CCc5ccccc5C4)n3)[nH]c2c1 |
| Inchi | InChI=1S/C22H20N4O/c1-27-17-9-10-18-20(13-17)25-22(24-18)19-7-4-8-21(23-19)26-12-11-15-5-2-3-6-16(15)14-26/h2-10,13H,11-12,14H2,1H3,(H,24,25) |
| Inchi Key | FVDILLFKFXBKPD-UHFFFAOYSA-N |
| Molecular Species | NEUTRAL |
| Targets | 6.0 |
| Bioactivities | 15.0 |
| Np Likeness Score | -1.17 |
| Records Key | ['BD3'] |
| Records Name | ['2-(6-(6-methoxy-1H-benzo[d]imidazol-2-yl)pyridin-2-yl)-1,2,3,4-tetrahydroisoquinoline'] |
| Withdrawn Flag | False |
| Orphan | -1 |
Molecular Structure
