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Yorodumi- ChemComp-I48: N-{3-METHYL-5-[2-(PYRIDIN-4-YLAMINO)-ETHOXY]-PHENYL}-BENZENESULFO... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: I48 |
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Name | Name: |
-Chemical information
Composition | Formula: C20H22N3O3S / Number of atoms: 49 / Formula weight: 384.472 / Formal charge: 1 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: I48 / Model coordinates PDB-ID: 1UVT | ||||
History |
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External links | UniChem / ChemSpider / DrugBank / PubChem / 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-1uvt:
BOVINE THROMBIN--BM14.1248 COMPLEX