| BioID | bio2785 |
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| Name | MOZAVAPTAN |
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| ChEMBL ID | CHEMBL420762 |
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| Molecular Formula | C27H29N3O2 |
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| Molecular Weight | 427.55 |
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| Molecular Weight (Monoisotopic) | 427.226 |
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| Type | Small molecule |
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| Max Phase | Phase 4 |
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| Target ID | Tar12 |
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| Target Name | Toll-like receptor 9 (TLR9) |
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| Synonyms | MOZAVAPTAN|MOZAVAPTANE|Mozavaptan |
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| Smiles | Cc1ccccc1C(=O)Nc1ccc(C(=O)N2CCCC(N(C)C)c3ccccc32)cc1 |
|---|
| Inchi | InChI=1S/C27H29N3O2/c1-19-9-4-5-10-22(19)26(31)28-21-16-14-20(15-17-21)27(32)30-18-8-13-24(29(2)3)23-11-6-7-12-25(23)30/h4-7,9-12,14-17,24H,8,13,18H2,1-3H3,(H,28,31) |
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| Inchi Key | WRNXUQJJCIZICJ-UHFFFAOYSA-N |
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| Molecular Species | BASE |
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| Targets | 40.0 |
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| Bioactivities | 84.0 |
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| Np Likeness Score | -1.34 |
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| Records Key | ['2', '3', 'OPC-31260', 'MOZAVAPTAN', 'SID170466304', '31b', '3', 'Mozavaptan hydrochloride脗', 'Mozavaptan', 'MOZAVAPTAN', 'mozavaptan', 'Mozavaptan hydrochloride脢', 'Mozavaptan', 'MOZAVAPTAN', 'MOZAVAPTAN', 'Mozavaptan', 'COVC-2825064875', 'mozavaptan'] |
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| Records Name | ['N-[4-(5-Dimethylamino-2,3,4,5-tetrahydro-benzo[b]azepine-1-carbonyl)-phenyl]-2-methyl-benzamide', 'N-[4-(5-Dimethylamino-2,3,4,5-tetrahydro-benzo[b]azepine-1-carbonyl)-phenyl]-2-methyl-benzamide', 'N-(4-(5-(dimethylamino)-2,3,4,5-tetrahydro-1H-benzo[b]azepine-1-carbonyl)phenyl)-2-methylbenzamide', 'MOZAVAPTAN', 'SID170466304', 'N-[4-(5-Dimethylamino-2,3,4,5-tetrahydro-benzo[b]azepine-1-carbonyl)-phenyl]-2-methyl-benzamide', 'N-[4-(5-Dimethylamino-2,3,4,5-tetrahydro-benzo[b]azepine-1-carbonyl)-phenyl]-2-methyl-benzamide', 'Mozavaptan hydrochloride脗', 'Mozavaptan', 'MOZAVAPTAN', 'mozavaptan', 'Mozavaptan hydrochloride脢', 'Mozavaptan', 'MOZAVAPTAN', 'MOZAVAPTAN', 'Mozavaptan', 'MOZAVAPTAN', 'mozavaptan'] |
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| Withdrawn Flag | False |
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| Orphan | 0 |
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