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Yorodumi- ChemComp-8ME: 3-(4-oxo-3,4-dihydroquinazolin-2-yl)-N-[(1S)-1-(pyridin-2-yl)ethy... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 8ME |
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Name | Name: |
-Chemical information
Composition | Formula: C18H18N4O2 / Number of atoms: 42 / Formula weight: 322.361 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 8ME / Ideal coordinates details: Corina / Model coordinates PDB-ID: 4GV0 | ||||
History |
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External links | UniChem / BindingDB / Brenda / ChEMBL / 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-4gv0:
Human ARTD3 (PARP3) - Catalytic domain in complex with inhibitor ME0355