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Yorodumi- ChemComp-1SI: 3-fluoranyl-~{N}-[(~{E})-(5-pyridin-2-ylsulfanylfuran-2-yl)methyl... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 1SI |
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Name | Name: |
-Chemical information
Composition | Formula: C17H12FN3O2S / Number of atoms: 36 / Formula weight: 341.359 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: 1SI / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7F8H | ||||
History |
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External links | UniChem / ChemSpider / BindingDB / ChEMBL / PubChem / SureChEMBL / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-PDB entries
Showing all 1 items
PDB-7f8h:
Structure-activity relationship studies of allosteric inhibitors of EYA2 tyrosine phosphatase