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Yorodumi- ChemComp-2NQ: N-{2-chloro-5-[4-(morpholin-4-yl)quinolin-6-yl]pyridin-3-yl}-4-fl... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 2NQ |
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Name | Name: |
-Chemical information
Composition | Formula: C24H20ClFN4O3S / Number of atoms: 54 / Formula weight: 498.957 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 2NQ / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3S2A | ||||||
History |
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External links | BindingDB / UniChem / ChEMBL / PubChem / PubChem_TPharma / SureChEMBL / 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 1.7.2 | |
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-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.2 | |
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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 1.7.2 | |
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-PDB entries
Showing all 1 items
PDB-3s2a:
Crystal structure of PI3K-gamma in complex with a quinoline inhibitor