| BioID | bio2909 |
|---|
| Name | CLOPERASTINE |
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| ChEMBL ID | CHEMBL415087 |
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| Molecular Formula | C20H24ClNO |
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| Molecular Weight | 329.87 |
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| Molecular Weight (Monoisotopic) | 329.1546 |
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| Type | Small molecule |
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| Max Phase | Phase 2 |
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| Target ID | Tar12 |
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| Target Name | Toll-like receptor 9 (TLR9) |
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| Synonyms | CLOPERASTINA|CLOPERASTINE|CLOPERASTINE FENDIZOATE|CLOPERASTINE HYDROCHLORIDE|HT-11|NSC-758635 |
|---|
| Smiles | Clc1ccc(C(OCCN2CCCCC2)c2ccccc2)cc1 |
|---|
| Inchi | InChI=1S/C20H24ClNO/c21-19-11-9-18(10-12-19)20(17-7-3-1-4-8-17)23-16-15-22-13-5-2-6-14-22/h1,3-4,7-12,20H,2,5-6,13-16H2 |
|---|
| Inchi Key | FLNXBVJLPJNOSI-UHFFFAOYSA-N |
|---|
| Molecular Species | BASE |
|---|
| Targets | 39.0 |
|---|
| Bioactivities | 54.0 |
|---|
| Np Likeness Score | -0.98 |
|---|
| Records Key | ['56, cloperastine', 'Cloperastine', 'CLOPERASTINE', 'CLOPERASTINE', 'DNDI2266597', 'Cloperastine', 'cloperastine', 'COVC-1751601832', 'CLOPERASTINE HYDROCHLORIDE', 'COVC-0134874669', 'cloperastine', 'BA1000069'] |
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| Records Name | ['1-(2-((4-chlorophenyl)(phenyl)methoxy)ethyl)piperidine', 'Cloperastine', 'CLOPERASTINE', 'CLOPERASTINE', None, 'Cloperastine', 'cloperastine', 'CLOPERASTINE', 'CLOPERASTINE HYDROCHLORIDE', 'CLOPERASTINE HYDROCHLORIDE', 'cloperastine', 'CLOPERASTINE'] |
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| Withdrawn Flag | False |
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| Orphan | 0 |
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