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Yorodumi- ChemComp-740: N-[5-(1,1-DIOXIDOISOTHIAZOLIDIN-2-YL)-1H-INDAZOL-3-YL]-2-(4-PIPER... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 740 |
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Name | Name: |
-Chemical information
Composition | Formula: C23H27N5O3S / Number of atoms: 59 / Formula weight: 453.557 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 740 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 2R64 | ||||
History |
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External links | UniChem / BindingDB / Brenda / ChEMBL / DrugBank / PubChem / PubChem_TPharma / SureChEMBL / ZINC / ChemSpider / 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 1 items
PDB-2r64:
Crystal structure of a 3-aminoindazole compound with CDK2