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Yorodumi- ChemComp-CGI: ~{N}-[4-(4-chloranylphenoxy)phenyl]-7~{H}-pyrrolo[2,3-d]pyrimidin... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: CGI |
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Name | Name: ~{ |
-Chemical information
Composition | Formula: C18H13ClN4O / Number of atoms: 37 / Formula weight: 336.775 / Formal charge: 0 | ||||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: CGI / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7QHW | ||||||
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 1.06 |
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-InChIKey
InChI 1.06 |
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-PDB entries
Showing all 1 items
PDB-7qhw:
TTBK1 kinase domain in complex with inhibitor 29