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Yorodumi- ChemComp-C5I: 3-oxo-3-[(3R)-3-(pyrrolo[2,3-b][1,2,3]triazolo[4,5-d]pyridin-1(6H... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: C5I |
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Name | Name: |
-Chemical information
Composition | Formula: C15H15N7O / Number of atoms: 38 / Formula weight: 309.326 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: C5I / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4I5C | ||||
History |
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External links | UniChem / ChemSpider / BindingDB / ChEMBL / SureChEMBL / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
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-SMILES CANONICAL
CACTVS 3.370 | 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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-SYSTEMATIC NAME
ACDLabs 12.01 |
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-PDB entries
Showing all 1 items
PDB-4i5c:
The Jak1 kinase domain in complex with inhibitor