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Yorodumi- ChemComp-DJV: N-[(1R,2S)-1-[(2R,4R)-4-(cyclohexylmethoxy)pyrrolidin-2-yl]-3-(3,... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: DJV |
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Name | Name: |
-Chemical information
Composition | Formula: C22H32F2N2O3 / Number of atoms: 61 / Formula weight: 410.498 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: DJV / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6BFE | ||||
History |
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External links | UniChem / ChemSpider / ChEMBL / PubChem / 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 2.0.6 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.6 | |
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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 2.0.6 | ~{ | |
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-PDB entries
Showing all 1 items
PDB-6bfe:
BACE crystal structure with hydroxy pyrrolidine inhibitor