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Yorodumi- ChemComp-EV6: (3S)-3-(2-amino-5-chloro-1H-benzimidazol-1-yl)-N-[(1R,3S,5R,7R)-t... -
+Open data
-Basic information
Entry | Database: PDB chemical components / ID: EV6 |
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Name | Name: ( |
-Chemical information
Composition | Formula: C22H29ClN4O / Number of atoms: 57 / Formula weight: 400.945 / Formal charge: 0 | ||||||||
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Others | Type: NON-POLYMER / PDB classification: HETAIN / Three letter code: EV6 / Ideal coordinates details: Corina / Model coordinates PDB-ID: 3S2O | ||||||||
History |
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External links | UniChem / ChemSpider / Wikipedia search / Google search |
-Structure visualization
Structure viewer | Molecule: MolmilJmol/JSmol |
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-Details
-SMILES
ACDLabs 12.01 | CACTVS 3.370 | OpenEye OEToolkits 1.7.2 | |
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-SMILES CANONICAL
CACTVS 3.370 | OpenEye OEToolkits 1.7.2 | |
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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 1.7.2 | ( | |
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-PDB entries
Showing all 1 items
PDB-3s2o:
Fragment based discovery and optimisation of bace-1 inhibitors