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Yorodumi- ChemComp-7EY: 3-[5-(4-methylphenyl)thieno[2,3-d]pyrimidin-4-yl]sulfanylpropanoi... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 7EY |
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Name | Name: |
-Chemical information
Composition | Formula: C16H14N2O2S2 / Number of atoms: 36 / Formula weight: 330.425 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 7EY / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5M44 | ||||
History |
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External links | UniChem / ChEMBL / ChemicalBook / CompTox / PubChem / PubChem_TPharma / 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 2.0.6 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
OpenEye OEToolkits 2.0.6 |
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-PDB entries
Showing all 3 items
PDB-5m44:
Complex structure of human protein kinase CK2 catalytic subunit with a thieno[2,3-d]pyrimidin inhibitor crystallized under high-salt conditions
PDB-5m4c:
Complex structure of human protein kinase CK2 catalytic subunit with a thieno[2,3-d]pyrimidin inhibitor crystallized under low-salt conditions
PDB-6z1c:
Crystal structure of Arabidopsis thaliana CK2-alpha-1 in complex with TTP-22