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Yorodumi- ChemComp-C9Q: 4-(3-chlorophenyl)-~{N}-ethyl-1~{H}-pyrrolo[2,3-b]pyridine-2-carb... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: C9Q |
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Name | Name: |
-Chemical information
Composition | Formula: C16H14ClN3O / Number of atoms: 35 / Formula weight: 299.755 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: C9Q / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6F1X | ||||
History |
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External links | UniChem / BindingDB / ChEMBL / PubChem / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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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
OpenEye OEToolkits 2.0.6 |
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-PDB entries
Showing all 1 items
PDB-6f1x:
Complex between MTH1 and compound 7 (a 7-azaindole-2-amide derivative)