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Yorodumi- ChemComp-E7N: ~{N}-[5-[2-azanyl-5-(4-piperazin-1-ylphenyl)pyridin-3-yl]-2-metho... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: E7N |
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Name | Name: ~{ |
-Chemical information
Composition | Formula: C25H31N5O3S / Number of atoms: 65 / Formula weight: 481.61 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: E7N / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6FU5 | ||||
History |
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External links | UniChem / ChemSpider / 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 2.0.6 | |
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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 1 items
PDB-6fu5:
Structure of the kinase domain of human RIPK2 in complex with the inhibitor CSLP18