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Yorodumi- ChemComp-1H9: 8-[(3-bromophenyl)methoxy]-4~{H}-thieno[2,3-c]isoquinolin-5-one -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 1H9 |
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Name | Name: |
-Chemical information
Composition | Formula: C18H12BrNO2S / Number of atoms: 35 / Formula weight: 386.262 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: 1H9 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7OTF | ||||
History |
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External links | UniChem / ChEMBL / ChemSpider / 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 1.03 |
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-InChIKey
InChI 1.03 |
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-PDB entries
Showing all 1 items
PDB-7otf:
PARP15 catalytic domain in complex with OUL213