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Yorodumi- ChemComp-LQY: N-(2-amino-2-oxoethyl)-5'-[(4aR,8aS)-3-cycloheptyl-4-oxo-3,4,4a,5... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: LQY |
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Name | Name: |
-Chemical information
Composition | Formula: C31H36N4O4 / Number of atoms: 75 / Formula weight: 528.642 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: LQY / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5G2B | ||||
History |
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External links | UniChem / BindingDB / ChEMBL / PubChem / 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 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
ACDLabs 12.01 | OpenEye OEToolkits 1.7.6 | |
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-PDB entries
Showing all 1 items
PDB-5g2b:
Crystal structure of T. brucei PDE-B1 catalytic domain with inhibitor NPD-008