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Yorodumi- ChemComp-R90: ~{N}-[5-[[(3~{R})-1-(5-azanyl-1,3,4-thiadiazol-2-yl)pyrrolidin-3-... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: R90 |
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Name | Name: ~{ |
-Chemical information
Composition | Formula: C16H18N8OS2 / Number of atoms: 45 / Formula weight: 402.497 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: R90 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 8BSL | ||||
History |
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External links | UniChem / BindingDB / ChEMBL / PubChem / 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-8bsl:
Human GLS in complex with compound 12