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Yorodumi- ChemComp-TH4: {(2Z)-3-[(6-chloropyridin-3-yl)methyl]-1,3-thiazolidin-2-ylidene}... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: TH4 |
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Name | Name: {( |
-Chemical information
Composition | Formula: C10H9ClN4S / Number of atoms: 25 / Formula weight: 252.723 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: TH4 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3C84 | ||||||
History |
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External links | UniChem / ChemSpider / BindingDB / Brenda / ChEBI / ChEMBL / CompTox / DrugBank / KEGG_Ligand / Nikkaji / PubChem_TPharma / SureChEMBL / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 10.04 | CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-SMILES CANONICAL
CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 10.04 | {(OpenEye OEToolkits 1.5.0 | ( | |
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-PDB entries
Showing all 3 items
PDB-3c84:
Crystal structure of a complex of AChBP from aplysia californica and the neonicotinoid thiacloprid
PDB-3wtj:
Crystal Structure of Lymnaea stagnalis Acetylcholine Binding Protein Complexed with Thiacloprid
PDB-3wtk:
Crystal Structure of Lymnaea stagnalis Acetylcholine-Binding Protein Q55R Mutant Complexed with Thiacloprid