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Yorodumi- ChemComp-5QA: ~{N}-[[2,6-bis(chloranyl)phenyl]methyl]-2-oxidanyl-ethanamide -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 5QA |
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Name | Name: ~{ |
-Chemical information
Composition | Formula: C9H9Cl2NO2 / Number of atoms: 23 / Formula weight: 234.079 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 5QA / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5ENI | ||||
History |
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External links | UniChem / ChemSpider / PubChem / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.4 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.4 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
OpenEye OEToolkits 2.0.4 | ~{ |
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-PDB entries
Showing all 1 items
PDB-5eni:
Crystal structure of the second bromodomain of Pleckstrin homology domain interacting protein (PHIP) in complex with compound-13 N11537 (SGC - Diamond I04-1 fragment screening)