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Yorodumi- ChemComp-TO7: (4-amino-2-{[(1S,2S,4R)-bicyclo[2.2.1]heptan-2-yl]amino}-1,3-thia... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: TO7 |
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Name | Name: ( Synonyms: MC180295 |
-Chemical information
Composition | Formula: C17H18N4O3S / Number of atoms: 43 / Formula weight: 358.415 / Formal charge: 0 | ||||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: TO7 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6W9E | ||||||
History |
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External links | UniChem / ChemSpider / ChEMBL / PubChem / 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-6w9e:
Crystal Structure of Human CDK9/cyclinT1 in complex with MC180295