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- ChemComp-8IS: N-[(2S)-3-(cyclohexylmethylamino)-2-oxidanyl-propyl]-2,2-diphenyl... -
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Open data
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Basic information
Entry | ![]() |
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Name | Name: Synonyms: N-[(2S)-3-[(cyclohexylmethyl)amino]-2-hydroxypropyl]-2,2-diphenylacetamide |
-Chemical information
Composition | |||||||||
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Others | Type: non-polymer / PDB classification: HETAIN / Three letter code: 8IS / Ideal coordinates details: Corina / Model coordinates PDB-ID: 7Q1M | ||||||||
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Structure visualization
Structure viewer | Molecule: ![]() ![]() |
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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 1.06 |
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-InChIKey
InChI 1.06 |
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-PDB entries
Showing all 1 items
![](data/pdb/img/7q1m.jpg)
PDB-7q1m:
Crystal structure of human butyrylcholinesterase in complex with N-[(2S)-3-[(cyclohexylmethyl)amino]-2-hydroxypropyl]-2,2-diphenylacetamide