| BioID | bio2381 |
|---|
| Name | BRADANICLINE HYDROCHLORIDE |
|---|
| ChEMBL ID | CHEMBL3137311 |
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| Molecular Formula | C22H24ClN3O2 |
|---|
| Molecular Weight | 397.91 |
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| Molecular Weight (Monoisotopic) | 361.179 |
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| Type | Small molecule |
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| Max Phase | Unknown |
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| Target ID | Tar12 |
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| Target Name | Toll-like receptor 9 (TLR9) |
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| Synonyms | BRADANICLINE HYDROCHLORIDE|TC-5619-023 |
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| Smiles | Cl.O=C(N[C@@H]1C2CCN(CC2)[C@H]1Cc1cccnc1)c1cc2ccccc2o1 |
|---|
| Inchi | InChI=1S/C22H23N3O2.ClH/c26-22(20-13-17-5-1-2-6-19(17)27-20)24-21-16-7-10-25(11-8-16)18(21)12-15-4-3-9-23-14-15;/h1-6,9,13-14,16,18,21H,7-8,10-12H2,(H,24,26);1H/t18-,21+;/m0./s1 |
|---|
| Inchi Key | ISPRRZDPZDVHLE-OZYANKIXSA-N |
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| Molecular Species | NEUTRAL |
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| Targets | None |
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| Bioactivities | None |
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| Np Likeness Score | -0.49 |
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| Records Key | ['BRADANICLINE HYDROCHLORIDE'] |
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| Records Name | ['BRADANICLINE HYDROCHLORIDE'] |
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| Withdrawn Flag | False |
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| Orphan | 0 |
|---|
