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Yorodumi- ChemComp-5T4: ~{N}-[(1-pyrimidin-2-ylpiperidin-4-yl)methyl]pyrrolidine-1-carboxamide -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 5T4 |
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Name | Name: ~{ |
-Chemical information
Composition | Formula: C15H23N5O / Number of atoms: 44 / Formula weight: 289.376 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 5T4 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5EZG | ||||
History |
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External links | UniChem / PubChem / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.4 | |
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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-5ezg:
Structure of Transcriptional Regulatory Repressor Protein - EthR from Mycobacterium Tuberculosis in complex with compound 22 at 1.84A resolution