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Yorodumi- ChemComp-0WR: 2-[1-({2-[2-(dimethylamino)-1H-benzimidazol-1-yl]-9-methyl-6-(mor... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 0WR |
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Name | Name: |
-Chemical information
Composition | Formula: C28H39N9O2 / Number of atoms: 78 / Formula weight: 533.668 / Formal charge: 0 | ||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 0WR / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4GB9 | ||
History |
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External links | UniChem / ChemSpider / BindingDB / ChEMBL / 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 3.370 | OpenEye OEToolkits 1.7.6 | |
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-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
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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 1.7.6 | |
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-PDB entries
Showing all 1 items
PDB-4gb9:
Potent and Highly Selective Benzimidazole Inhibitors of PI3K-delta