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Yorodumi- ChemComp-QOA: N-[(2S)-2,3-dihydroxypropyl]-3-[(2-fluoro-4-iodophenyl)amino]pyri... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: QOA |
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Name | Name: |
-Chemical information
Composition | Formula: C15H15FIN3O3 / Number of atoms: 38 / Formula weight: 431.201 / Formal charge: 0 | ||||||
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Others | 6v30 | ||||||
History |
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External links | UniChem / ChemSpider / BindingDB / Brenda / ChEBI / ChEMBL / CompTox / DrugBank / GtoPharmacology / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / 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-7m0w:
Crystal structure of the BRAF:MEK1 kinases in complex with AMPPNP and Pimasertib