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Yorodumi- ChemComp-XTD: {2-amino-4-[3,5-bis(trifluoromethyl)phenyl]thiophen-3-yl}(4-chlor... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: XTD |
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Name | Name: { |
-Chemical information
Composition | Formula: C19H10ClF6NOS / Number of atoms: 39 / Formula weight: 449.797 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: XTD / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7LD3 | ||||
History |
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External links | UniChem / ChemSpider / ChEMBL / PubChem / PubChem_TPharma / SureChEMBL / ZINC / 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-7ld3:
Cryo-EM structure of the human adenosine A1 receptor-Gi2-protein complex bound to its endogenous agonist and an allosteric ligand