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Yorodumi- ChemComp-9LL: (2R)-2-(5-fluoro-2-hydroxyphenyl)-2-(1-oxo-1,3-dihydro-2H-isoindo... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 9LL |
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Name | Name: ( |
-Chemical information
Composition | Formula: C19H14FN3O3S / Number of atoms: 41 / Formula weight: 383.396 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 9LL / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5ZWJ | ||||
History |
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External links | UniChem / BindingDB / ChEMBL / PubChem / ZINC / ChemSpider / 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 2.0.6 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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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 2.0.6 | ( | |
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-PDB entries
Showing all 4 items
PDB-5zwj:
Crystal structure of EGFR 675-1022 T790M/C797S/V948R in complex with EAI045
PDB-6p1l:
Crystal structure of EGFR in complex with EAI045
PDB-6z4b:
Crystal Structure of EGFR-T790M/V948R in Complex with Osimertinib and EAI045
PDB-7jxm:
EGFR kinase (T790M/V948R) in complex with osimertinib and EAI045