| BioID | bio2791 |
|---|
| Name | TEBANICLINE |
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| ChEMBL ID | CHEMBL430497 |
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| Molecular Formula | C9H11ClN2O |
|---|
| Molecular Weight | 198.65 |
|---|
| Molecular Weight (Monoisotopic) | 198.056 |
|---|
| Type | Small molecule |
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| Max Phase | Phase 2 |
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| Target ID | Tar12 |
|---|
| Target Name | Toll-like receptor 9 (TLR9) |
|---|
| Synonyms | TEBANICLINA|TEBANICLINE |
|---|
| Smiles | Clc1ccc(OC[C@H]2CCN2)cn1 |
|---|
| Inchi | InChI=1S/C9H11ClN2O/c10-9-2-1-8(5-12-9)13-6-7-3-4-11-7/h1-2,5,7,11H,3-4,6H2/t7-/m1/s1 |
|---|
| Inchi Key | MKTAGSRKQIGEBH-SSDOTTSWSA-N |
|---|
| Molecular Species | BASE |
|---|
| Targets | 14.0 |
|---|
| Bioactivities | 44.0 |
|---|
| Np Likeness Score | -0.57 |
|---|
| Records Key | ['2 (ABT-594)', '4', 'ABT-594', '19', 'tebeniciline', 'ABT-594', '5 (ABT-594)', 'tebanicline', 'tebanicline'] |
|---|
| Records Name | ['5-((R)-1-Azetidin-2-ylmethoxy)-2-chloro-pyridine', '5-((R)-1-Azetidin-2-ylmethoxy)-2-chloro-pyridine', '5-((R)-1-Azetidin-2-ylmethoxy)-2-chloro-pyridine', '5-((R)-1-Azetidin-2-ylmethoxy)-2-chloro-pyridine', 'tebeniciline', '5-((R)-1-Azetidin-2-ylmethoxy)-2-chloro-pyridine', '5-((S)-1-Azetidin-2-ylmethoxy)-2-chloro-pyridine', 'tebanicline', 'tebanicline'] |
|---|
| Withdrawn Flag | False |
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| Orphan | 0 |
|---|
