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Yorodumi- ChemComp-NQE: 2-[(1,3-dimethyl-2-oxidanylidene-benzimidazol-5-yl)amino]pyridine... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: NQE |
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Name | Name: |
-Chemical information
Composition | Formula: C15H13N5O / Number of atoms: 34 / Formula weight: 279.297 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: NQE / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6TOF | ||||
History |
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External links | UniChem / BindingDB / ChEMBL / 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 2.0.7 | |
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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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-PDB entries
Showing all 1 items
PDB-6tof:
Crystal structure of human BCL6 BTB domain in complex with compound 4