+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 505 |
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Name | Name: ( |
-Chemical information
Composition | Formula: C11H17NO / Number of atoms: 30 / Formula weight: 179.259 / Formal charge: 0 | ||||||
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Others | Type: non-polymer / Three letter code: 505 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 2VIN | ||||||
History |
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External links | UniChem / ChemSpider / BindingDB / ChEMBL / CompTox / DrugBank / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / 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-2vin:
Fragment-Based Discovery of Mexiletine Derivatives as Orally Bioavailable Inhibitors of Urokinase-Type Plasminogen Activator