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Yorodumi- ChemComp-FYP: ethyl 8-fluoro-5-methyl-6-oxo-5,6-dihydro-4H-imidazo[1,5-a][1,4]b... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: FYP | ||||
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Name | Name: Synonyms: Flumazenil Wikipedia | Wikipedia - Flumazenil: Flumazenil (also known as flumazepil, code name Ro 15-1788) is a selective GABAA receptor antagonist administered via injection, otic insertion, or intranasally. Therapeutically, it acts as both an antagonist and antidote to benzodiazepines (particularly in cases of overdose), through competitive inhibition.
| It was first characterized in 1981, and was first marketed in 1987 by Hoffmann-La Roche under the trade name Anexate... Comment | antagonist*YM | |
-Chemical information
Composition | Formula: C15H14FN3O3 / Number of atoms: 36 / Formula weight: 303.288 / Formal charge: 0 | ||||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: FYP / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6D6U | ||||||||
History |
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External links | UniChem / BindingDB / ChEBI / ChEMBL / ChemicalBook / CompTox / DailyMed / DrugBank / GtoPharmacology / HMDB / KEGG_Ligand / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / ChemSpider / 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 4 items
PDB-6d6t:
Human GABA-A receptor alpha1-beta2-gamma2 subtype in complex with GABA and flumazenil, conformation B
PDB-6d6u:
Human GABA-A receptor alpha1-beta2-gamma2 subtype in complex with GABA and flumazenil, conformation A
PDB-6x3u:
Human GABAA receptor alpha1-beta2-gamma2 subtype in complex with GABA plus flumazenil
PDB-8bgi:
GABA-A receptor a5 homomer - a5V1 - Flumazenil