| BioID | bio197829 |
|---|
| Name | None |
|---|
| ChEMBL ID | CHEMBL394568 |
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| Molecular Formula | C13H11N5O2S |
|---|
| Molecular Weight | 301.33 |
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| Molecular Weight (Monoisotopic) | 301.0633 |
|---|
| Type | Small molecule |
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| Max Phase | -- |
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| Target ID | Tar81 |
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| Target Name | None |
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| Synonyms | 2-(3-Nitrobenzoyl)Pyridine Thiosemicarbazone |
|---|
| Smiles | NC(=S)N/N=C(\c1cccc([N+](=O)[O-])c1)c1ccccn1 |
|---|
| Inchi | InChI=1S/C13H11N5O2S/c14-13(21)17-16-12(11-6-1-2-7-15-11)9-4-3-5-10(8-9)18(19)20/h1-8H,(H3,14,17,21)/b16-12+ |
|---|
| Inchi Key | HXNQGIAFXDHXCH-FOWTUZBSSA-N |
|---|
| Molecular Species | NEUTRAL |
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| Targets | 2.0 |
|---|
| Bioactivities | 4.0 |
|---|
| Np Likeness Score | -1.98 |
|---|
| Records Key | ['NBpT'] |
|---|
| Records Name | ['2-(3-nitrobenzoyl)pyridine thiosemicarbazone'] |
|---|
| Withdrawn Flag | False |
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| Orphan | -1 |
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