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Yorodumi- ChemComp-1BL: (2R)-5-{[(2S,3R)-4-{[1-(3-tert-butylphenyl)cyclohexyl]amino}-1-(3... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 1BL |
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Name | Name: ( |
-Chemical information
Composition | Formula: C31H42F2N2O5 / Number of atoms: 82 / Formula weight: 560.672 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 1BL / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4I0H | ||||
History |
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External links | UniChem / PubChem / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.6 | |
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-SMILES CANONICAL
CACTVS 3.370 | 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
ACDLabs 12.01 | (OpenEye OEToolkits 1.7.6 | ( | |
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-PDB entries
Showing all 1 items
PDB-4i0h:
SPR and structural analysis yield insight towards mechanism of inhibition of BACE inhibitors.