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Yorodumi- ChemComp-VBM: METHYL {(7R)-6-CYANO-7-(4-CYANOPHENYL)-5-METHYL-4-[3-(TRIFLUOROME... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: VBM |
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Name | Name: |
-Chemical information
Composition | Formula: C23H16F3N7O2 / Number of atoms: 51 / Formula weight: 479.414 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: VBM / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5A8Y | ||||
History |
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External links | UniChem / ChemSpider / PubChem / SureChEMBL / ZINC / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 1.7.6 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 1.7.6 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
OpenEye OEToolkits 1.7.6 |
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-PDB entries
Showing all 1 items
PDB-5a8y:
Crystal Structure of human neutrophil elastase in complex with a dihydropyrimidone inhibitor