+Open data
-Basic information
Entry | Database: PDB chemical components / ID: QMU |
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Name | Name: Synonyms: ~{tert}-butyl (7~{S})-14-bromanyl-12-oxidanylidene-2,4,11-triazatetracyclo[11.4.0.0^{2,6}.0^{7,11}]heptadeca-1(17),3,5,13,15-pentaene-5-carboxylate |
-Chemical information
Composition | Formula: C19H20BrN3O3 / Number of atoms: 46 / Formula weight: 418.284 / Formal charge: 0 | ||||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: QMU / Ideal coordinates details: Corina / Model coordinates PDB-ID: 8BHG | ||||||
History |
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External links | UniChem / BindingDB / ChEMBL / ChemicalBook / CompTox / GtoPharmacology / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 3.1.0.0 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 3.1.0.0 | |
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-InChI
InChI 1.06 |
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-InChIKey
InChI 1.06 |
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-PDB entries
Showing all 1 items
PDB-8bhg:
GABA-A receptor a5 heteromer - a5V2 - Bretazenil