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- ChemComp-RUX: [4-amino-2-methyl-6-(pyridin-2-yl-kappaN)quinazolin-7-yl-kappaC~7... -
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Open data
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Basic information
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Name | Name: [ |
-Chemical information
Composition | |||||||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: RUX / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3WHW | ||||||||||
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Structure visualization
Structure viewer | Molecule: ![]() ![]() |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.385 | OpenEye OEToolkits 1.7.6 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 1.7.6 | |
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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
![](data/pdb/img/3whw.jpg)
PDB-3whw:
MTH1 in complex with Ruthenium-based inhibitor