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Yorodumi- ChemComp-1IG: N-{2-[6-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)-2,2-DIMETHYL-3-OXO-2,... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 1IG |
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Name | Name: |
-Chemical information
Composition | Formula: C20H26N6O2S / Number of atoms: 55 / Formula weight: 414.524 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 1IG / Model coordinates PDB-ID: 2G1N | ||||||
History |
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External links | UniChem / DrugBank / PubChem / ZINC / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 10.04 | CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-SMILES CANONICAL
CACTVS 3.341 | OpenEye OEToolkits 1.5.0 | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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-SYSTEMATIC NAME
ACDLabs 10.04 | OpenEye OEToolkits 1.5.0 | |
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-PDB entries
Showing all 1 items
PDB-2g1n:
Ketopiperazine-based renin inhibitors: Optimization of the "C" ring