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Yorodumi- ChemComp-Q2D: 3-{[(3R)-3-({6-amino-8-[(6-iodo-2H-1,3-benzodioxol-5-yl)sulfanyl]... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: Q2D |
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Name | Name: |
-Chemical information
Composition | Formula: C25H24FIN6O4S2 / Number of atoms: 63 / Formula weight: 682.529 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: Q2D / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6U98 | ||||
History |
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External links | UniChem / PubChem / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | 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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-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 2.0.7 | |
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-PDB entries
Showing all 1 items
PDB-6u98:
Hsp90a NTD K58R bound reversibly to sulfonyl fluoride 6