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- ChemComp-8YD: 1-{4-[6-chloro-8-fluoro-7-(5-methyl-1H-indazol-4-yl)quinazolin-4-... -
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Open data
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Basic information
Entry | ![]() |
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Name | Name: Synonyms: KRAS(G12C) inhibitor, acrylamide form, bound form |
-Chemical information
Composition | |||||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 8YD / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5V6S | ||||||||
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Structure visualization
Structure viewer | Molecule: ![]() ![]() |
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-Details
-SMILES
ACDLabs 12.01 | 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
ACDLabs 12.01 | OpenEye OEToolkits 2.0.6 | |
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-PDB entries
Showing all 1 items
![](data/pdb/img/5v6s.jpg)
PDB-5v6s:
Crystal structure of small molecule acrylamide 1 covalently bound to K-Ras G12C