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Yorodumi- ChemComp-NZX: 1-[6-[3-cyclohexyl-5-methyl-4-(5-methyl-1~{H}-indazol-4-yl)pyrazo... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: NZX |
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Name | Name: Synonyms: 1-[6-[3-cyclohexyl-5-methyl-4-(5-methyl-1H-indazol-4-yl)pyrazol-1-yl]-2-azaspiro[3.3]heptan-2-yl]prop-2-en-1-one (precursor) |
-Chemical information
Composition | Formula: C27H35N5O / Number of atoms: 68 / Formula weight: 445.6 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: NZX / Ideal coordinates details: Corina / Model coordinates PDB-ID: 8AQ7 | ||||
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 3.1.0.0 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 3.1.0.0 | |
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-InChI
InChI 1.06 |
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-InChIKey
InChI 1.06 |
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-PDB entries
Showing all 1 items
PDB-8aq7:
KRAS G12C IN COMPLEX WITH GDP AND COMPOUND 9