+Open data
-Basic information
Entry | Database: PDB chemical components / ID: VBK |
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Name | Name: [( Synonyms: 4H,6H,7H-thieno[3,2-c]pyran-4-ylmethanamine; 6,7-dihydro-4H-thieno[3,2-c]pyran-4-ylmethanamine; 12225896 |
-Chemical information
Composition | Formula: C8H11NOS / Number of atoms: 22 / Formula weight: 169.244 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: VBK / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7OF9 | ||||
History |
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External links | UniChem / PubChem / SureChEMBL / ZINC / ChemSpider / 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-7of9:
Keap1 kelch domain bound to a small molecule fragment