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Yorodumi- ChemComp-P43: 1-{3-[1-({5-[(2-fluorophenyl)ethynyl]furan-2-yl}carbonyl)piperidi... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: P43 |
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Name | Name: |
-Chemical information
Composition | Formula: C25H23FN2O2 / Number of atoms: 53 / Formula weight: 402.461 / Formal charge: 0 | ||||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: P43 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4A6L | ||||||
History |
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External links | UniChem / ChemSpider / BindingDB / ChEMBL / CompTox / Nikkaji / 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 3.385 | OpenEye OEToolkits 1.9.2 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 1.9.2 | |
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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 1.9.2 | [ | |
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-PDB entries
Showing all 1 items
PDB-4a6l:
beta-tryptase inhibitor