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Yorodumi- ChemComp-IKH: {(4S)-2-methyl-6-[(1-methyl-4-phenyl-1H-imidazol-2-yl)ethynyl]imi... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: IKH |
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Name | Name: {( |
-Chemical information
Composition | Formula: C20H17N5O / Number of atoms: 43 / Formula weight: 343.382 / Formal charge: 0 | ||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: IKH / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5SFF | ||||
History |
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External links | UniChem / ChemSpider / BindingDB / PubChem / SureChEMBL / 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 2.0.7 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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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 2.0.7 | [ | |
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-PDB entries
Showing all 1 items
PDB-5sff:
CRYSTAL STRUCTURE OF HUMAN PHOSPHODIESTERASE 10 IN COMPLEX WITH c1cc(nn2c1nc(c2CO)C)C#Cc3nc(cn3C)c4ccccc4, micromolar IC50=0.00103