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Yorodumi- ChemComp-YM5: (3-{4-[(2S)-2-(AMINOMETHYL)MORPHOLIN-4-YL]-7H-PYRROLO[2,3-D]PYRIM... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: YM5 |
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Name | Name: ( |
-Chemical information
Composition | Formula: C18H21N5O2 / Number of atoms: 46 / Formula weight: 339.392 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: YM5 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 2YM5 | ||||
History |
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External links | UniChem / ChemSpider / PubChem / ZINC / 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 1.9.2 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 1.9.2 | |
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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 1.9.2 | [ | |
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-PDB entries
Showing all 1 items
PDB-2ym5:
Crystal structure of checkpoint kinase 1 (Chk1) in complex with inhibitors