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Yorodumi- ChemComp-9DB: (2~{R})-2-azanyl-2-cyclohexyl-~{N}-[2-(1-methylpyrazol-4-yl)-9-ox... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 9DB |
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Name | Name: ( |
-Chemical information
Composition | Formula: C22H25N7O2 / Number of atoms: 56 / Formula weight: 419.48 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 9DB / Ideal coordinates details: Corina / Model coordinates PDB-ID: 5NXC | ||||
History |
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External links | UniChem / ChEMBL / ChemicalBook / DrugBank / Nikkaji / PubChem / PubChem_TPharma / SureChEMBL / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
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
OpenEye OEToolkits 2.0.6 | ( |
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-PDB entries
Showing all 1 items
PDB-5nxc:
LIM Domain Kinase 1 (LIMK1) In Complex With PF-00477736