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Yorodumi- ChemComp-LJV: 6-{[(6-chloro-2-oxo-1,2-dihydroquinolin-3-yl)methyl]amino}-2-meth... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: LJV |
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Name | Name: |
-Chemical information
Composition | Formula: C17H13ClN4O / Number of atoms: 36 / Formula weight: 324.764 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: LJV / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6O2Z | ||||
History |
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External links | UniChem / ChemSpider / BindingDB / ChEMBL / PubChem / SureChEMBL / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | 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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-SYSTEMATIC NAME
ACDLabs 12.01 | OpenEye OEToolkits 2.0.7 | |
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-PDB entries
Showing all 1 items
PDB-6o2z:
Crystal structure of IDH1 R132H mutant in complex with compound 32