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Yorodumi- ChemComp-TWI: (2~{S})-10-[(3-chloranyl-2-fluoranyl-pyridin-4-yl)amino]-2-cyclop... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: TWI |
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Name | Name: ( |
-Chemical information
Composition | Formula: C21H18ClF3N4O2 / Number of atoms: 49 / Formula weight: 450.841 / Formal charge: 0 | ||||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: TWI / Ideal coordinates details: Corina / Model coordinates PDB-ID: 8C78 | ||||||
History |
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External links | UniChem / ChemSpider / PubChem / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
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 1.06 |
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-InChIKey
InChI 1.06 |
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-PDB entries
Showing all 1 items
PDB-8c78:
Crystal structure of human BCL6 BTB domain in complex with compound CCT374705