| BioID | bio3148 |
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| Name | BEPOTASTINE BESYLATE |
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| ChEMBL ID | CHEMBL1201759 |
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| Molecular Formula | C27H31ClN2O6S |
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| Molecular Weight | 547.07 |
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| Molecular Weight (Monoisotopic) | 388.1554 |
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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 | BB|BEPOTASTINE BENZENESULFONATE SALT|BEPOTASTINE BESILATE|BEPOTASTINE BESYLATE|BEPREVE|Bepotastine Besilate|TALION|TAU-284 |
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| Smiles | O=C(O)CCCN1CCC(O[C@@H](c2ccc(Cl)cc2)c2ccccn2)CC1.O=S(=O)(O)c1ccccc1 |
|---|
| Inchi | InChI=1S/C21H25ClN2O3.C6H6O3S/c22-17-8-6-16(7-9-17)21(19-4-1-2-12-23-19)27-18-10-14-24(15-11-18)13-3-5-20(25)26;7-10(8,9)6-4-2-1-3-5-6/h1-2,4,6-9,12,18,21H,3,5,10-11,13-15H2,(H,25,26);1-5H,(H,7,8,9)/t21-;/m0./s1 |
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| Inchi Key | UDGHXQPQKQPSBB-BOXHHOBZSA-N |
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| Molecular Species | ZWITTERION |
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| Targets | 2.0 |
|---|
| Bioactivities | 4.0 |
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| Np Likeness Score | -0.97 |
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| Records Key | ['BEPOTASTINE BESYLATE', 'BEPOTASTINE BESILATE', 'BEPOTASTINE BESYLATE', 'Bepotastine Besilate', 'Bepotastine Besilate', 'BEPOTASTINE BESYLATE'] |
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| Records Name | ['BEPOTASTINE BESYLATE', 'BEPOTASTINE BESILATE', 'BEPOTASTINE BESYLATE', 'Bepotastine Besilate', 'Bepotastine Besilate', 'BEPOTASTINE BESYLATE'] |
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| Withdrawn Flag | False |
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| Orphan | 0 |
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