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Yorodumi- ChemComp-A78: N-{1-BENZYL-3-HYDROXY-4-[3-METHYL-2-(3-METHYL-3-PYRIDIN-2-YLMETHY... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: A78 |
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Name | Name: |
-Chemical information
Composition | Formula: C44H60N8O5 / Number of atoms: 117 / Formula weight: 780.998 / Formal charge: 2 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: A78 / Model coordinates PDB-ID: 1HVJ | ||||
History |
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External links | UniChem / PubChem / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 10.04 | CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-SMILES CANONICAL
CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 10.04 | OpenEye OEToolkits 1.5.0 | ( | |
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-PDB entries
Showing all 1 items
PDB-1hvj:
INFLUENCE OF STEREOCHEMISTRY ON ACTIVITY AND BINDING MODES FOR C2 SYMMETRY-BASED DIOL INHIBITORS OF HIV-1 PROTEASE