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Yorodumi- ChemComp-ORL: 3-[(~{E})-[3-sulfanyl-5-[4-(trifluoromethyl)phenyl]-1,2,4-triazol... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: ORL |
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Name | Name: |
-Chemical information
Composition | Formula: C17H11F3N4O2S / Number of atoms: 38 / Formula weight: 392.355 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: ORL / Ideal coordinates details: Corina / Model coordinates PDB-ID: 8B1Z | ||||
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-8b1z:
NDM-1 metallo-beta-lactamase in complex with triazole-based inhibitor CP56