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Yorodumi- ChemComp-JT2: 4-[[(2~{S})-1-azanylpropan-2-yl]amino]-6-(sulfanylmethyl)-1-benzo... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: JT2 |
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Name | Name: |
-Chemical information
Composition | Formula: C13H18N4S2 / Number of atoms: 37 / Formula weight: 294.439 / Formal charge: 0 | ||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: JT2 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 6R5L | ||||
History |
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External links | UniChem / PubChem / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | |
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-SMILES CANONICAL
CACTVS 3.385 | OpenEye OEToolkits 2.0.7 | [ | |
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-InChI
InChI 1.03 |
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-InChIKey
InChI 1.03 |
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