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Yorodumi- ChemComp-NJH: ~{N}-[3-[4-(2-chlorophenyl)-5-pyrimidin-4-yl-1,2,4-triazol-3-yl]-... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: NJH |
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Name | Name: ~{ |
-Chemical information
Composition | Formula: C23H18ClN7O / Number of atoms: 50 / Formula weight: 443.888 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: NJH / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6TKN | ||||
History |
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External links | UniChem / 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-6tkn:
Tankyrase 2 in complex with an inhibitor (OM-1000)