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Yorodumi- ChemComp-4IG: (2S)-6-(2,4-DIAMINO-6-ETHYLPYRIMIDIN-5-YL)-2-(3,5-DIFLUOROPHENYL)... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: 4IG |
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Name | Name: ( |
-Chemical information
Composition | Formula: C24H25F2N5O3 / Number of atoms: 59 / Formula weight: 469.484 / Formal charge: 0 | ||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: 4IG / Model coordinates PDB-ID: 2G1S | ||||||
History |
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External links | UniChem / ChemSpider / DrugBank / PubChem / ZINC / 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-2g1s:
Ketopiperazine-Based Renin Inhibitors: Optimization of the C Ring